SCHEMBL782124

SCHEMBL782124

CCCn1cc(N)cc1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.41
TYR P14679 1/20 0.38
HSD17B10 Q99714 3/20 0.34
MAPK1 P28482 1/20 0.34
KDM5A P29375 1/20 0.33
KDM5B Q9UGL1 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
CYP2C19 P33261 1/20 0.33
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 3/20 0.33
HPGD P15428 2/20 0.33
GPR35 Q9HC97 2/20 0.33
CNR2 P34972 1/20 0.32
HCAR3 P49019 1/20 0.32
MCL1 Q07820 3/20 0.32
GRN P28799 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL783152 0.90 TYR (0.41) L3MBTL1TYRHSD17B10CA12CA1
SCHEMBL780340 0.85 GPR35 (0.38) L3MBTL1HSD17B10MAPK1CA12CA1
SCHEMBL8657835 0.82 TYR (0.38) L3MBTL1TYRHSD17B10MAPK1KDM5A
SCHEMBL8102670 0.81 KDM4E (0.38) L3MBTL1TYRHSD17B10CA12CA1
SCHEMBL5889466 0.81 HTT (0.39) HSD17B10MAPK1KDM4ESORT1
SCHEMBL22066872 0.80 TYR (0.42) L3MBTL1TYRHSD17B10MAPK1KDM5A
SCHEMBL781811 0.75 TDP1 (0.45) HSD17B10CYP2C19ALDH1A1KDM4EHPGD
SCHEMBL5676062 0.73 AR (0.41) ALDH1A1
Hydrochloric Acid SCHEMBL7049628 0.73 TDP1 (0.44) HSD17B10CYP2C19ALDH1A1KDM4EHPGD
SCHEMBL782206 0.68 L3MBTL1 (0.41) L3MBTL1TYRKDM5AKDM5BCYP2C19

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120071628-A1 TOPICAL THERAPEUTIC AGENT FOR OPHTHALMIC DISEASES COMPRISING COMPOUND CAPABLE OF BINDING SPECIFICALLY TO DNA SEQUENCE NIHON UNIVERSITY (JP) 2012-03-22 US disclosed
US-20110046070-A1 GENE EXPRESSION INHIBITOR SELECTIVE FOR MATRIX METALLOPROTEINASE-9 GENE NIHON UNIVERSITY (JP) 2011-02-24 US disclosed
US-7888516-B2 transforming growth factor (TGF- beta ) gene expression inhibitors comprising a pyrrole-imidazole polyamides, used as a therapeutic agent for diseases associated with the production of TGF- beta; drugs; side effect reduction NIHON UNIVERSITY (JP) 2011-02-15 US disclosed
EP-2266583-A1 GENE EXPRESSION INHIBITOR SELECTIVE FOR MATRIX METALLOPROTEINASE-9 GENE Nihon University (JP) 2010-12-29 EP disclosed
US-7807844-B2 TGF-β gene expression inhibitor NIHON UNIVERSITY (JP) 2010-10-05 US disclosed
US-20080255368-A1 Tgf-ß Gene Expression Inhibitor NIHON UNIVERSITY (JP) 2008-10-16 US disclosed
US-20080103187-A1 Tgf-Beta Gene Expression Inhibitor GENTIER BIOSYSTEMS, INC. (JP) 2008-05-01 US disclosed
EP-1779850-A1 TGF- GENE EXPRESSION INHIBITOR Nihon University (JP) 2007-05-02 EP disclosed
US-7067622-B2 Method of the solid phase synthesis of pyrrole-imidazole polyamide JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2006-06-27 US disclosed
US-7064218-B2 Aromatic compounds and poly(oxyalkylene) containing aromatic compounds possessing antibacterial, antifungal or antitumor activity GENELABS TECHNOLOGIES, INC. (US) 2006-06-20 US disclosed
US-20040171799-A1 Method of the solid phase synhesis of pyrrole-imidazole polyamide JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2004-09-02 US disclosed
US-20030212113-A1 Novel aromatic compounds and poly(oxyalkylene) containing aromatic compounds possessing antibacterial, antifungal or antitumor activity GLAXOSMITHKLINE LLC 2003-11-13 US disclosed
WO-2003057212-A1 POLYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL, ANTIFUNGAL OR ANTITUMOR ACTIVITY GENELABS TECHNOLOGIES, INC. (US) 2003-07-17 WO disclosed
US-20030119749-A1 Novel compounds possessing antibacterial, antifungal or antitumor activity SMITHKLINE BEECHAM CORPORATION 2003-06-26 US disclosed
EP-1294713-A2 COMPOUNDS POSSESSING ANTIBACTERIAL, ANTIFUNGAL OR ANTITUMOR ACTIVITY GENELABS TECHNOLOGIES, INC. (US) 2003-03-26 EP disclosed
WO-2002000650-A9 NOVEL COMPOUNDS POSSESSING ANTIBACTERIAL, ANTIFUNGAL OR ANTITUMOR ACTIVITY GENELABS TECH INC (US) 2003-03-06 WO disclosed
US-20020037856-A1 Novel compounds possessing antibacterial, antifungal or antitumor activity GENELABS TECHNOLOGIES, INC. 2002-03-28 US disclosed
WO-2002000650-A2 NOVEL COMPOUNDS POSSESSING ANTIBACTERIAL, ANTIFUNGAL OR ANTITUMOR ACTIVITY GENELABS TECHNOLOGIES, INC. (US) 2002-01-03 WO disclosed
EP-0661260-B1 New bi-aromatic compounds derived from amides pharmaceutical compositions and cosmetic compositions containing them and their use CIRD GALDERMA (FR) 1997-03-12 EP disclosed
EP-0661260-A1 New bi-aromatic compounds derived from amides pharmaceutical compositions and cosmetic compositions containing them and their use CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA, ( CIRD GALDERMA) (FR) 1995-07-05 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040171799-A1 Method of the solid phase synhesis of pyrrole-imidazole polyamide PCNA, POLH, PNISR L3MBTL1 2924/4885TYR 2453/4885HSD17B10 4626/4885
US-20120071628-A1 TOPICAL THERAPEUTIC AGENT FOR OPHTHALMIC DISEASES COMPRISING COMPOUND CAPABLE OF BINDING SPECIFICALLY TO DNA SEQUENCE POLH, POLB, POLK L3MBTL1 4494/4885TYR 1487/4885HSD17B10 3576/4885
US-20080255368-A1 Tgf-ß Gene Expression Inhibitor GABRP, GABRB2, GABRB1 L3MBTL1 671/4885TYR 4399/4885HSD17B10 3070/4885
US-20030119749-A1 Novel compounds possessing antibacterial, antifungal or antitumor activity CYP51A1, MCL1, ERG28 L3MBTL1 4293/4885TYR 156/4885HSD17B10 2227/4885
US-20110046070-A1 GENE EXPRESSION INHIBITOR SELECTIVE FOR MATRIX METALLOPROTEINASE-9 GENE GABRP, GABRD, MMP9 L3MBTL1 1217/4885TYR 3009/4885HSD17B10 3459/4885
US-20080103187-A1 Tgf-Beta Gene Expression Inhibitor TGFBR1, TGFBR2, SMAD2 L3MBTL1 285/4885TYR 4290/4885HSD17B10 3330/4885
US-20020037856-A1 Novel compounds possessing antibacterial, antifungal or antitumor activity CYP51A1, MCL1, ERG28 L3MBTL1 4293/4885TYR 156/4885HSD17B10 2227/4885
US-20030212113-A1 Novel aromatic compounds and poly(oxyalkylene) containing aromatic compounds possessing antibacterial, antifungal or antitumor activity TYR, CYP51A1, ODC1 L3MBTL1 4222/4885TYR 1/4885HSD17B10 1184/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.