SCHEMBL3933015

SCHEMBL3933015

CN(C)CCN(c1ccc(N/C(=C2\C(=O)Nc3cc(Cl)ccc32)c2ccc3c(c2)oc(=O)n3C)cc1)S(C)(=O)=O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.38
TP53 P04637 3/20 0.36
KDM4E B2RXH2 1/20 0.35
TSHR P16473 2/20 0.35
ALDH1A1 P00352 1/20 0.35
POLB P06746 3/20 0.34
TDP1 Q9NUW8 3/20 0.34
MAPT P10636 2/20 0.34
LMNA P02545 3/20 0.34
MAPK1 P28482 3/20 0.33
HSD17B10 Q99714 2/20 0.33
USP2 O75604 1/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
GFER P55789 1/20 0.33

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
SCHEMBL3945313 0.88 KDM4E (0.38) PKMTP53KDM4ETSHRALDH1A1
SCHEMBL3934197 0.87 KDM4E (0.39) PKMTP53KDM4ETSHRALDH1A1
SCHEMBL3935651 0.86 TP53 (0.38) PKMTP53KDM4ETSHRALDH1A1
SCHEMBL3935672 0.85 ALPL (0.38) KDM4EALDH1A1POLBTDP1MAPT
SCHEMBL3930243 0.85 KDM4E (0.37) PKMTP53KDM4ETSHRALDH1A1
SCHEMBL3937682 0.85 KDM4E (0.39) PKMTP53KDM4ETSHRALDH1A1
SCHEMBL5856936 0.85 KDM4E (0.39) PKMTP53KDM4ETSHRALDH1A1
SCHEMBL3935382 0.84 LMNA (0.35) TSHRALDH1A1POLBTDP1MAPT
SCHEMBL4494272 0.83 GAA (0.38) TP53TSHRALDH1A1POLBMAPT
SCHEMBL4494278 0.83 GAA (0.38) TP53TSHRALDH1A1POLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1551830-B1 HETEROCYCLICALLY SUBSTITUTED INDOLINONES AND THEIR USE AS RECEPTOR TYROSINE KINASE INHIBATORS BOEHRINGER INGELHEIM PHARMA (DE) 2009-04-08 EP disclosed
US-7148249-B2 Indolinones substituted by heterocycles, the preparation thereof and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2006-12-12 US disclosed
EP-1551830-A2 HETEROCYCLICALLY SUBSTITUTED INDOLINONES AND THEIR USE AS RECEPTOR TYROSINE KINASE INHIBATORS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-07-13 EP disclosed
US-20050054710-A1 Indolinones substituted by heterocycles, the preparation thereof and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-03-10 US disclosed
WO-2004026829-A2 HETEROCYCLICALLY SUBSTITUTED INDOLINONES AND THEIR USE AS RECEPTOR TYROSINE KINASE INHIBITORS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-04-01 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 (1 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-20050054710-A1 Indolinones substituted by heterocycles, the preparation thereof and their use as medicaments CDK1, CDK2, CDK3 PKM 303/4885TP53 398/4885KDM4E 902/4885

“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.