SCHEMBL21391413

SCHEMBL21391413

CO[C@H](C(=O)Nc1ccc(C)c(OC2CCN(C(=O)c3cn(C)cn3)CC2)c1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIT P10721 4/20 0.45
ABL1 P00519 3/20 0.45
CSF1R P07333 2/20 0.44
PDGFRB P09619 2/20 0.44
DDR1 Q08345 2/20 0.44
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
RBP4 P02753 1/20 0.41
KMT2A Q03164 2/20 0.40
LCK P06239 1/20 0.40
BLK P51451 1/20 0.40
DDR2 Q16832 1/20 0.40
HTT P42858 2/20 0.40
MAPT P10636 1/20 0.40
RECQL P46063 1/20 0.40
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
PIK3CD O00329 1/20 0.38
PIK3CA P42336 1/20 0.38

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
SCHEMBL21391396 1.00 KIT (0.45) KITABL1CSF1RPDGFRBDDR1
SCHEMBL21391401 0.92 KIT (0.46) KITABL1CSF1RPDGFRBDDR1
SCHEMBL21391375 0.92 KIT (0.46) KITABL1CSF1RPDGFRBDDR1
SCHEMBL21391328 0.86 KIT (0.57) KITABL1CSF1RPDGFRBDDR1
SCHEMBL21391419 0.82 CSF1R (0.44) KITCSF1RPDGFRBDDR1ALDH1A1
SCHEMBL21391408 0.82 CSF1R (0.44) KITCSF1RPDGFRBDDR1ALDH1A1
SCHEMBL21391398 0.81 KIT (0.54) KITABL1CSF1RPDGFRBDDR1
SCHEMBL21391411 0.81 KIT (0.54) KITABL1CSF1RPDGFRBDDR1
SCHEMBL21391417 0.81 ALDH1A1 (0.53) KITABL1CSF1RPDGFRBDDR1
SCHEMBL21391399 0.81 ALDH1A1 (0.53) KITABL1CSF1RPDGFRBDDR1

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