SCHEMBL21391333

SCHEMBL21391333

Cc1ccc(NC(=O)c2ccccc2)cc1OC1CCN(C(=O)c2ccc[nH]2)CC1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KIT P10721 6/20 0.58
CSF1R P07333 2/20 0.58
PDGFRB P09619 2/20 0.58
DDR1 Q08345 2/20 0.58
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
MAPT P10636 1/20 0.49
ABL1 P00519 5/20 0.48
LCK P06239 1/20 0.45
BLK P51451 1/20 0.45
DDR2 Q16832 1/20 0.45
NAMPT P43490 1/20 0.45
ACHE P22303 1/20 0.45
BACE1 P56817 1/20 0.45
FKBP5 Q13451 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
ABCB1 P08183 1/20 0.41

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
SCHEMBL21391362 0.87 KIT (0.59) KITCSF1RPDGFRBDDR1KMT2A
SCHEMBL21391343 0.85 KIT (0.58) KITCSF1RPDGFRBDDR1KMT2A
SCHEMBL21391408 0.85 CSF1R (0.44) KITCSF1RPDGFRBDDR1KMT2A
SCHEMBL21391419 0.85 CSF1R (0.44) KITCSF1RPDGFRBDDR1KMT2A
SCHEMBL21391331 0.85 KIT (0.77) KITCSF1RPDGFRBDDR1KMT2A
SCHEMBL21391342 0.82 KIT (0.55) KITCSF1RPDGFRBDDR1KMT2A
SCHEMBL21385153 0.82 KIT (0.66) KITCSF1RPDGFRBDDR1KMT2A
SCHEMBL21391338 0.82 KIT (0.66) KITCSF1RPDGFRBDDR1KMT2A
SCHEMBL21391340 0.82 KIT (0.59) KITCSF1RPDGFRBDDR1KMT2A
SCHEMBL29634986 0.82 KIT (0.66) KITCSF1RPDGFRBDDR1KMT2A

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