SCHEMBL783152

SCHEMBL783152

CCCCn1cc(N)cc1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.41
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ICMT O60725 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TLR8 Q9NR97 4/20 0.35
MCL1 Q07820 3/20 0.35
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRB1 P18505 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35
GABRA5 P31644 1/20 0.35
GABRA3 P34903 1/20 0.35

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
SCHEMBL782124 0.90 L3MBTL1 (0.41) TYRCA12CA1CA2CA9
SCHEMBL780340 0.82 GPR35 (0.38) CA12CA1CA2CA9KDM4E
SCHEMBL5889466 0.79 HTT (0.39) KDM4EHSD17B10
SCHEMBL8657835 0.72 TYR (0.38) TYRCA12CA1CA2CA9
SCHEMBL781811 0.72 TDP1 (0.45) KDM4EALDH1A1HSD17B10MCL1GAA
SCHEMBL8102670 0.72 KDM4E (0.38) TYRCA12CA1CA2CA9
SCHEMBL1606352 0.71 CNR2 (0.43) MCL1CNR2
SCHEMBL12438310 0.71 LMNA (0.41) CA12CA1CA2CA9KDM4E
Hydrochloric Acid SCHEMBL7049628 0.71 TDP1 (0.44) KDM4EALDH1A1HSD17B10MCL1GAA
SCHEMBL22066872 0.70 TYR (0.42) TYRCA12CA1CA2CA9

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 11 patents. 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
CN-1845733-A TGF-beta gene expression inhibitors UNIV NIHON (JP) 2006-10-11 CN 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-20040171799-A1 Method of the solid phase synhesis of pyrrole-imidazole polyamide JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2004-09-02 US 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 (5 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 TYR 2453/4885CA12 854/4885CA1 1474/4885
US-20120071628-A1 TOPICAL THERAPEUTIC AGENT FOR OPHTHALMIC DISEASES COMPRISING COMPOUND CAPABLE OF BINDING SPECIFICALLY TO DNA SEQUENCE POLH, POLB, POLK TYR 1487/4885CA12 2036/4885CA1 3771/4885
US-20080255368-A1 Tgf-ß Gene Expression Inhibitor GABRP, GABRB2, GABRB1 TYR 4399/4885CA12 4475/4885CA1 3863/4885
US-20110046070-A1 GENE EXPRESSION INHIBITOR SELECTIVE FOR MATRIX METALLOPROTEINASE-9 GENE GABRP, GABRD, MMP9 TYR 3009/4885CA12 1051/4885CA1 424/4885
US-20080103187-A1 Tgf-Beta Gene Expression Inhibitor TGFBR1, TGFBR2, SMAD2 TYR 4290/4885CA12 4599/4885CA1 4045/4885

“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.