SCHEMBL4738259

SCHEMBL4738259

Cc1ccc2c(NCCc3ccc(NC(=O)c4ccc(Cl)nc4)cc3)nc(Cl)nc2c1

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 19/20 0.69
TCF7L2 Q9NQB0 19/20 0.69
RAB9A P51151 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54

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
SCHEMBL4738362 0.93 CTNNB1 (0.61) CTNNB1TCF7L2RAB9ASMN1; SMN2
SCHEMBL4166958 0.91 CTNNB1 (0.82) CTNNB1TCF7L2
SCHEMBL4739672 0.90 CTNNB1 (0.84) CTNNB1TCF7L2
Hydrochloric Acid SCHEMBL4736475 0.89 CTNNB1 (0.83) CTNNB1TCF7L2
SCHEMBL4740031 0.87 CTNNB1 (0.65) CTNNB1TCF7L2
SCHEMBL4168157 0.84 CTNNB1 (0.79) CTNNB1TCF7L2
SCHEMBL4740153 0.83 CTNNB1 (0.76) CTNNB1TCF7L2
SCHEMBL4737801 0.82 CTNNB1 (0.55) CTNNB1TCF7L2RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL4735277 0.82 CTNNB1 (0.75) CTNNB1TCF7L2
SCHEMBL4170148 0.81 CTNNB1 (1.00) CTNNB1TCF7L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008086462-A2 AMINO-SUBSTITUTED QUINAZOLINE DERIVATIVES AS INHIBITORS OF β-CANTENIN/TCF-4 PATHWAY AND CANCER TREATMENT AGENTS WYETH (US) 2008-07-17 WO disclosed