SCHEMBL14366808

SCHEMBL14366808

COC(=O)Cc1cccc(C2CN(c3ccc(F)cc3)CCC2C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
NOTUM Q6P988 1/20 0.40
HTR7 P34969 1/20 0.39
CHRM4 P08173 1/20 0.38
ALDH1A1 P00352 2/20 0.38
MCL1 Q07820 2/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
F10 P00742 3/20 0.37
SIGMAR1 Q99720 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
KDM4E B2RXH2 1/20 0.37
RORC P51449 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
PKM P14618 1/20 0.37
ALOX12 P18054 1/20 0.37

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
SCHEMBL14366806 0.89 NOTUM (0.45) POLBNOTUMCHRM4ALDH1A1MCL1
SCHEMBL3932377 0.83 PKM (0.49) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL3933560 0.73 THRB (0.44) SMN1; SMN2ALDH1A1MAPTKMT2ATDP1
SCHEMBL14366366 0.72 PKM (0.49) POLBMAPTMEN1KMT2AL3MBTL1
SCHEMBL3936577 0.72 SLC7A5 (0.41) POLBALDH1A1MAPTPKM
SCHEMBL3942799 0.72 NPC1 (0.55) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL14172860 0.71 RAB9A (0.51) POLBSMN1; SMN2CHRM4ALDH1A1MCL1
SCHEMBL3941870 0.71 PKM (0.55) MAPTMEN1KMT2AL3MBTL1PKM
SCHEMBL3933544 0.71 RAB9A (0.53) POLBSMN1; SMN2ALDH1A1MAPTKMT2A
SCHEMBL14190853 0.70 ALDH1A1 (0.48) POLBSMN1; SMN2CHRM4ALDH1A1MAPT

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-2007146838-A2 SUBSTITUTED PHENYL ACETIC ACIDS AS DP-2 ANTAGONISTS ICOS CORPORATION (US) 2007-12-21 WO disclosed