SCHEMBL4597149

SCHEMBL4597149

COc1ccccc1CN1C(=O)C(=O)c2ccccc21

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 2/20 0.61
GAA P10253 2/20 0.60
KDM4E B2RXH2 1/20 0.60
RECQL P46063 1/20 0.60
CES1 P23141 5/20 0.56
CHRM1 P11229 2/20 0.56
ALDH1A1 P00352 2/20 0.56
ALDH2 P05091 2/20 0.56
ALDH3A1 P30838 2/20 0.56
USP2 O75604 1/20 0.55
HSD17B10 Q99714 1/20 0.55
MEN1 O00255 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
TSHR P16473 1/20 0.54
CYP2C19 P33261 1/20 0.54
KMT2A Q03164 1/20 0.54
BCHE P06276 2/20 0.54
ACHE P22303 1/20 0.54
CES2 O00748 1/20 0.52

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
SCHEMBL5424603 0.85 TP53 (0.60) TGM2KDM4ECES1CHRM1ALDH1A1
SCHEMBL18669183 0.83 GAA (0.78) GAAKDM4ERECQLALDH1A1USP2
Hydrochloric Acid SCHEMBL9098693 0.83 DRD2 (0.60) CES1ALDH1A1ALDH3A1BCHETP53
SCHEMBL18955078 0.82 CHRM5 (0.57) TGM2CES1CHRM1ALDH1A1ALDH2
SCHEMBL18954691 0.81 TGM2 (0.68) TGM2CES1CHRM1ALDH1A1ALDH2
SCHEMBL18955090 0.81 CA1 (0.69)
SCHEMBL15928248 0.80 TGM2 (0.75) TGM2CES1CHRM1ALDH1A1ALDH2
SCHEMBL12930291 0.79 CDC25A (0.56) GAAKDM4ERECQLUSP2HSD17B10
SCHEMBL4596003 0.79 CES1 (0.67) TGM2CES1CHRM1ALDH1A1ALDH2
SCHEMBL281572 0.79 TGM2 (0.57) TGM2CES1CHRM1ALDH1A1ALDH2

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017099695-A1 N-[(AMINOSULFONYL)PHENYL]-2-(1,2-DIHYDRO-2-OXO-3H-INDOL-3-YLIDENE)-HYDRAZINECARBOTHIOAMIDE DERIVATIVES FOR TREATING CANCER AND IMMUNOLOGICAL DISORDERS ISTANBUL UNIVERSITESI REKTORLUGU (TR) 2017-06-15 WO disclosed
WO-2017099695-A1 N-[(AMINOSULFONYL)PHENYL]-2-(1,2-DIHYDRO-2-OXO-3H-INDOL-3-YLIDENE)-HYDRAZINECARBOTHIOAMIDE DERIVATIVES FOR TREATING CANCER AND IMMUNOLOGICAL DISORDERS ISTANBUL UNIVERSITESI REKTORLUGU (TR) 2017-06-15 WO disclosed
US-9598441-B2 Therapeutic compounds and methods WAYNE STATE UNIVERSITY (US) 2017-03-21 US disclosed
US-20140221412-A1 THERAPEUTIC COMPOUNDS AND METHODS WAYNE STATE UNIVERSITY (US) 2014-08-07 US disclosed
EP-2750508-A1 THERAPEUTIC COMPOUNDS AND METHODS Wayne State University (US) 2014-07-09 EP disclosed
WO-2013033392-A1 THERAPEUTIC COMPOUNDS AND METHODS WAYNE STATE UNIVERSITY (US) 2013-03-07 WO disclosed
WO-2013033392-A1 THERAPEUTIC COMPOUNDS AND METHODS WAYNE STATE UNIVERSITY (US) 2013-03-07 WO disclosed
US-20110009379-A1 INDOLINONE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-01-13 US disclosed
US-20110009379-A1 INDOLINONE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-01-13 US disclosed
WO-2009123080-A1 INDOLINONE COMPOUND アステラス製薬株式会社 (JP) 2009-10-08 WO disclosed
WO-2008046083-A2 USE OF OXINDOLE COMPOUNDS AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2008-04-17 WO disclosed
EP-1877378-A2 OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2008-01-16 EP disclosed
US-20070105820-A1 Oxindole compounds and their uses as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2007-05-10 US disclosed
WO-2006113864-A2 OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2006-10-26 WO 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 (3 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-20070105820-A1 Oxindole compounds and their uses as therapeutic agents OPRL1, OPRK1, TRPV1 TGM2 4700/4885GAA 3046/4885KDM4E 3803/4885
US-20110009379-A1 INDOLINONE COMPOUND TRPA1, TRPV1, TRPV6 TGM2 2745/4885GAA 2363/4885KDM4E 4636/4885
US-20140221412-A1 THERAPEUTIC COMPOUNDS AND METHODS XPOT, FANCI, XPO5 TGM2 2152/4885GAA 193/4885KDM4E 3089/4885

“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.