SCHEMBL6329095

SCHEMBL6329095

CC/C(Nc1ccc(CN)cc1)=C1/C(=O)Nc2cc(OC)c(OC)cc21

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RET P07949 4/20 0.44
KLKB1 P03952 2/20 0.41
AKT2 P31751 1/20 0.40
EGFR P00533 1/20 0.39
BRD4 O60885 4/20 0.37
BRD2 P25440 2/20 0.37
CHEK1 O14757 2/20 0.37
PDPK1 O15530 1/20 0.37
TLK2 Q86UE8 1/20 0.35
EPHX2 P34913 1/20 0.35
PLG P00747 2/20 0.35
KLK1 P06870 2/20 0.35
KLK6 Q92876 2/20 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
SCHEMBL6329107 1.00 RET (0.44) RETKLKB1AKT2EGFRBRD4
SCHEMBL6329081 0.92 RET (0.42) RETAKT2EGFRBRD4BRD2
SCHEMBL6329067 0.92 RET (0.42) RETAKT2EGFRBRD4BRD2
SCHEMBL6337430 0.90 RET (0.41) RETEGFRBRD4BRD2CHEK1
SCHEMBL6337435 0.90 RET (0.41) RETEGFRBRD4BRD2CHEK1
SCHEMBL7475197 0.90 RET (0.41) RETEGFRBRD4BRD2CHEK1
SCHEMBL6330783 0.89 RET (0.44) RETAKT2EGFRBRD4CHEK1
SCHEMBL6330792 0.89 RET (0.44) RETAKT2EGFRBRD4CHEK1
SCHEMBL6336573 0.88 RET (0.43) RETEGFRBRD4BRD2CHEK1
SCHEMBL6336574 0.88 RET (0.43) RETEGFRBRD4BRD2CHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050009898-A1 New substituted indolinones, their manufacture and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-01-13 US disclosed
US-6794395-B1 Substituted indolinones, their manufacture and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-09-21 US disclosed
EP-1212318-A1 SUBSTITUTED INDOLINONES AS TYROSINE KINASE INHIBITORS Boehringer Ingelheim Pharma KG (DE) 2002-06-12 EP disclosed
WO-2001016130-A1 SUBSTITUTED INDOLINONES AS TYROSINE KINASE INHIBITORS BOEHRINGER INGELHEIM PHARMA KG (DE) 2001-03-08 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-20050009898-A1 New substituted indolinones, their manufacture and their use as medicaments CCNE1, CDK1, CCNI RET 154/4885KLKB1 4031/4885AKT2 956/4885

“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.