SCHEMBL6336573

SCHEMBL6336573

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

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RET P07949 4/20 0.43
EGFR P00533 1/20 0.41
BRD4 O60885 4/20 0.37
BRD2 P25440 2/20 0.37
CHEK1 O14757 1/20 0.36
HTR7 P34969 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TLK2 Q86UE8 2/20 0.35
POLB P06746 1/20 0.35
RAB9A P51151 1/20 0.35
ATM Q13315 1/20 0.35
KDM4E B2RXH2 1/20 0.35
GPR55 Q9Y2T6 1/20 0.35
ROCK2 O75116 1/20 0.35
EPHX2 P34913 1/20 0.34
PDPK1 O15530 1/20 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
SCHEMBL6336574 1.00 RET (0.43) RETEGFRBRD4BRD2CHEK1
SCHEMBL6338483 0.91 RET (0.42) RETEGFRBRD4BRD2CHEK1
SCHEMBL6338488 0.91 RET (0.42) RETEGFRBRD4BRD2CHEK1
SCHEMBL6409209 0.90 RET (0.42) RETEGFRBRD4BRD2CHEK1
SCHEMBL6409220 0.90 RET (0.42) RETEGFRBRD4BRD2CHEK1
SCHEMBL7480959 0.89 RET (0.43) RETEGFRBRD4BRD2CHEK1
SCHEMBL6329674 0.89 RET (0.48) RETEGFRBRD4BRD2MEN1
SCHEMBL6329682 0.89 RET (0.48) RETEGFRBRD4BRD2MEN1
SCHEMBL6335932 0.89 PDPK1 (0.44) RETBRD4BRD2ROCK2PDPK1
SCHEMBL6335940 0.89 PDPK1 (0.44) RETBRD4BRD2ROCK2PDPK1

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 2 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

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 154/4885EGFR 65/4885BRD4 439/4885

“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.