SCHEMBL3935943

SCHEMBL3935943

CN(C)CCN(c1ccc(N/C(=C2\C(=O)Nc3cc(Cl)ccc32)c2ccc3[nH]cnc3c2)cc1)S(C)(=O)=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
LIMK1 P53667 1/20 0.33
PLK1 P53350 3/20 0.32
CSF1R P07333 3/20 0.31
LMNA P02545 2/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
F10 P00742 1/20 0.30
PDGFRB P09619 2/20 0.30
KDR P35968 2/20 0.30
CES1 P23141 1/20 0.30
PLK3 Q9H4B4 1/20 0.30
EGFR P00533 1/20 0.30
INSR P06213 1/20 0.30
IGF1R P08069 1/20 0.30
KIT P10721 1/20 0.30

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
SCHEMBL5856378 0.94 NPC1 (0.43) MEN1KMT2ANPC1RAB9ALIMK1
SCHEMBL5857791 0.87 GPR55 (0.38) MEN1KMT2ANPC1RAB9APLK1
SCHEMBL3933644 0.87 GPR55 (0.38) MEN1KMT2ANPC1RAB9APLK1
SCHEMBL5858152 0.86 NPC1 (0.37) MEN1KMT2ANPC1RAB9APLK1
SCHEMBL3943820 0.86 NPC1 (0.37) MEN1KMT2ANPC1RAB9APLK1
SCHEMBL4494272 0.85 GAA (0.38) MEN1KMT2APLK1LMNAALDH1A1
SCHEMBL4494278 0.85 GAA (0.38) MEN1KMT2APLK1LMNAALDH1A1
SCHEMBL3935672 0.84 ALPL (0.38) MEN1KMT2ARAB9AKDM4EALDH1A1
SCHEMBL226907 0.84 MEN1 (0.46) MEN1KMT2ANPC1RAB9APLK1
SCHEMBL226908 0.84 MEN1 (0.46) MEN1KMT2ANPC1RAB9APLK1

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 MEN1 1664/4885KMT2A 1839/4885NPC1 4723/4885

“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.