SCHEMBL21391394

SCHEMBL21391394

Cc1ccc(NC(=O)C23CC4CC(CC(C4)C2)C3)cc1OC1CCN(C(=O)c2cccnc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIT P10721 5/20 0.55
CSF1R P07333 2/20 0.55
PDGFRB P09619 2/20 0.55
DDR1 Q08345 2/20 0.55
EPHX2 P34913 3/20 0.49
EPHX1 P07099 2/20 0.49
NAMPT P43490 1/20 0.48
ALDH1A1 P00352 5/20 0.47
HTT P42858 2/20 0.47
ABL1 P00519 4/20 0.46
TP53 P04637 2/20 0.46
KDM4E B2RXH2 1/20 0.46
HPGD P15428 1/20 0.46
LCK P06239 1/20 0.45
BLK P51451 1/20 0.45
DDR2 Q16832 1/20 0.45
GAA P10253 1/20 0.44
S1PR2 O95136 1/20 0.44
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL21391367 0.86 KIT (0.68) KITCSF1RPDGFRBDDR1NAMPT
SCHEMBL21391418 0.85 KIT (0.50) KITCSF1RPDGFRBDDR1EPHX2
SCHEMBL21385153 0.84 KIT (0.66) KITCSF1RPDGFRBDDR1NAMPT
SCHEMBL29634986 0.84 KIT (0.66) KITCSF1RPDGFRBDDR1NAMPT
SCHEMBL21391366 0.83 KIT (0.57) KITCSF1RPDGFRBDDR1NAMPT
SCHEMBL21391420 0.83 KIT (0.57) KITCSF1RPDGFRBDDR1NAMPT
SCHEMBL21391361 0.82 KIT (0.57) KITCSF1RPDGFRBDDR1NAMPT
SCHEMBL21391364 0.82 KIT (0.57) KITCSF1RPDGFRBDDR1EPHX2
SCHEMBL21391395 0.81 KIT (0.56) KITCSF1RPDGFRBDDR1EPHX2
SCHEMBL21391407 0.81 KIT (0.55) KITCSF1RPDGFRBDDR1NAMPT

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-2019178801-A1 NOVEL PHENOXY PIPERIDINE DERIVATIVE AND USES THEREOF 中国科学院合肥物质科学研究院 2019-09-26 WO disclosed