SCHEMBL3932610

SCHEMBL3932610

COC(=O)c1ccc2c(c1)NC(=O)C2=C(Nc1ccc(C(=O)N(C)CCN(C)C)cc1)c1ccncc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 7/20 0.41
BACE1 P56817 1/20 0.40
KMT2A Q03164 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
CASP1 P29466 1/20 0.36
HTR1D P28221 1/20 0.35
HTR1B P28222 1/20 0.35
CHEK1 O14757 1/20 0.35
PIK3CA P42336 3/20 0.35
MTOR P42345 3/20 0.35
PIK3CG P48736 3/20 0.35
POLB P06746 1/20 0.35
BCHE P06276 1/20 0.34
ROCK2 O75116 2/20 0.34

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
SCHEMBL3932609 1.00 NAMPT (0.41) NAMPTBACE1KMT2ACTDSP1CASP1
SCHEMBL3845027 0.91 MCHR1 (0.39) NAMPTBACE1KMT2ACTDSP1CASP1
SCHEMBL3932095 0.90 CDK2 (0.39) NAMPTBACE1
SCHEMBL3932096 0.90 CDK2 (0.39) NAMPTBACE1
SCHEMBL5857140 0.89 MAPT (0.39) NAMPTKMT2ACTDSP1CASP1PIK3CA
SCHEMBL5857136 0.89 MAPT (0.39) NAMPTKMT2ACTDSP1CASP1PIK3CA
SCHEMBL3944243 0.87 KMT2A (0.37) KMT2ACTDSP1CASP1PIK3CAMTOR
SCHEMBL3944246 0.87 KMT2A (0.37) KMT2ACTDSP1CASP1PIK3CAMTOR
SCHEMBL3941804 0.87 BACE1 (0.38) NAMPTBACE1KMT2ACTDSP1CASP1
SCHEMBL3941808 0.87 BACE1 (0.38) NAMPTBACE1KMT2ACTDSP1CASP1

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 3 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
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

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 NAMPT 1870/4885BACE1 1424/4885KMT2A 1839/4885

“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.