SCHEMBL4738362

SCHEMBL4738362

Cc1ccc2nc(Cl)nc(NCCc3ccc(NC(=O)c4ccc(Cl)nc4)cc3)c2c1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 19/20 0.61
TCF7L2 Q9NQB0 19/20 0.61
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
SCHEMBL4738259 0.93 CTNNB1 (0.69) CTNNB1TCF7L2RAB9ASMN1; SMN2
SCHEMBL4740153 0.90 CTNNB1 (0.76) CTNNB1TCF7L2
Hydrochloric Acid SCHEMBL4735277 0.89 CTNNB1 (0.75) CTNNB1TCF7L2
SCHEMBL4166958 0.84 CTNNB1 (0.82) CTNNB1TCF7L2
SCHEMBL4739672 0.83 CTNNB1 (0.84) CTNNB1TCF7L2
SCHEMBL4737801 0.82 CTNNB1 (0.55) CTNNB1TCF7L2RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL4736475 0.82 CTNNB1 (0.83) CTNNB1TCF7L2
SCHEMBL4167914 0.81 CTNNB1 (0.81) CTNNB1TCF7L2RAB9ASMN1; SMN2
SCHEMBL4167909 0.81 CTNNB1 (0.81) CTNNB1TCF7L2RAB9ASMN1; SMN2
SCHEMBL4170966 0.80 CTNNB1 (0.79) 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