SCHEMBL6337029

SCHEMBL6337029

COc1cc2c(cc1OC)C(=CC(C)Nc1ccc(CCN(C)C)cc1)C(=O)N2

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RET P07949 5/20 0.43
PSEN1 P49768 4/20 0.42
PSEN2 P49810 4/20 0.42
APH1B Q8WW43 4/20 0.42
NCSTN Q92542 4/20 0.42
APH1A Q96BI3 4/20 0.42
PSENEN Q9NZ42 4/20 0.42
FLT3 P36888 1/20 0.42
TLK2 Q86UE8 3/20 0.41
BRD4 O60885 2/20 0.37
SRC P12931 1/20 0.35
CHEK1 O14757 1/20 0.35
PRKAA2 P54646 1/20 0.35
PRKAA1 Q13131 1/20 0.35
GSK3B P49841 2/20 0.35
LRRK2 Q5S007 1/20 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
SCHEMBL6329628 0.94 RET (0.41) RETPSEN1PSEN2APH1BNCSTN
SCHEMBL6336955 0.90 PSEN1 (0.43) RETPSEN1PSEN2APH1BNCSTN
SCHEMBL6337189 0.90 RET (0.44) RETPSEN1PSEN2APH1BNCSTN
SCHEMBL6329073 0.88 RET (0.44) RETFLT3TLK2BRD4CHEK1
SCHEMBL6328845 0.87 RET (0.42) RETPSEN1PSEN2APH1BNCSTN
SCHEMBL6409215 0.87 RET (0.43) RETFLT3TLK2BRD4GSK3B
SCHEMBL6333458 0.87 PSEN1 (0.52) RETPSEN1PSEN2APH1BNCSTN
SCHEMBL6336551 0.86 RET (0.43) RETPSEN1PSEN2APH1BNCSTN
SCHEMBL6337433 0.86 RET (0.43) RETFLT3TLK2BRD4CHEK1
SCHEMBL6329102 0.86 RET (0.45) RETFLT3TLK2BRD4GSK3B

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 154/4885PSEN1 2014/4885PSEN2 3090/4885

“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.