SCHEMBL15949038

SCHEMBL15949038

Cc1cc(C(=O)CC(c2ccc(N3CCC(C(=O)O)CC3)cc2)c2ccc(F)cc2F)ccn1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 3/20 0.55
NOTUM Q6P988 1/20 0.40
GPR6 P46095 5/20 0.36
F10 P00742 1/20 0.36
FFAR4 Q5NUL3 1/20 0.35
KDM4E B2RXH2 2/20 0.35
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
USP2 O75604 1/20 0.35
HPGD P15428 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HSD17B10 Q99714 1/20 0.35
RAD52 P43351 1/20 0.35
POLB P06746 1/20 0.35
DEGS1 O15121 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
SCHEMBL362327 0.91 GPBAR1 (0.53) GPBAR1KDM4EHPGDNPSR1HSD17B10
SCHEMBL363896 0.90 GPBAR1 (0.69) GPBAR1NOTUMGPR6F10FFAR4
SCHEMBL1390177 0.90 GPBAR1 (0.69) GPBAR1NOTUMGPR6F10FFAR4
SCHEMBL365323 0.90 GPBAR1 (0.69) GPBAR1NOTUMGPR6F10FFAR4
SCHEMBL1389809 0.90 GPBAR1 (0.69) GPBAR1NOTUMGPR6F10FFAR4
SCHEMBL1390182 0.90 GPBAR1 (0.69) GPBAR1NOTUMGPR6F10FFAR4
SCHEMBL1389807 0.90 GPBAR1 (0.69) GPBAR1NOTUMGPR6F10FFAR4
SCHEMBL1389810 0.90 GPBAR1 (0.69) GPBAR1NOTUMGPR6F10FFAR4
SCHEMBL362799 0.85 GPBAR1 (0.50) GPBAR1NOTUMKDM4EUSP2HPGD
SCHEMBL362197 0.85 GPBAR1 (0.50) GPBAR1NOTUMKDM4EUSP2HPGD

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
EP-2593426-B1 1-HYDROXYIMINO-3-PHENYL-PROPANES HOFFMANN LA ROCHE (CH) 2014-08-20 EP disclosed