SCHEMBL13412807

SCHEMBL13412807

COC(=O)N1C2CN(CNCCc3ccc(F)cc3)C(=O)C(Cc3cccc4ccccc34)N2C(=O)CN1Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CLPP Q16740 4/20 0.43
▸ CTNNB1 P35222 2/20 0.43
▸ TCF7 P36402 2/20 0.43
▸ BCL9 O00512 1/20 0.43
▸ TCF4 P15884 1/20 0.43
▸ CREBBP Q92793 1/20 0.43
▸ CYP3A4 P08684 15/20 0.42

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
SCHEMBL750547 0.92 CLPP (0.45) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL14193074 0.84 CLPP (0.44) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL749225 0.72 CLPP (0.66) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL13028973 0.71 CTNNB1 (0.75) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL19505150 0.70 CTNNB1 (0.65) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL14629378 0.70 CLPP (0.62) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL397692 0.70 SMN1; SMN2 (0.45) CYP3A4
SCHEMBL750962 0.70 SMN1; SMN2 (0.45) CYP3A4
SCHEMBL747777 0.70 CLPP (0.56) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL12037197 0.69 CLPP (0.71) CLPPCTNNB1TCF7BCL9TCF4

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-7671054-B1 Reverse-turn mimetics and method relating thereto CHOONGWAE PHARMA CORPORATION (KR) 2010-03-02 — — US disclosed
US-7671054-B1 Reverse-turn mimetics and method relating thereto CHOONGWAE PHARMA CORPORATION (KR) 2010-03-02 — — US disclosed
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