SCHEMBL28045844

SCHEMBL28045844

O=C(O)NC[C@@H](O)Cc1ccccc1Cl

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.49
RAB9A P51151 1/20 0.49
PPARG P37231 1/20 0.44
PPARA Q07869 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CASR P41180 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
HIF1A Q16665 1/20 0.42
CTBP2 P56545 1/20 0.41
PLAAT3 P53816 1/20 0.40
PLAAT5 Q96KN8 1/20 0.40
PLAAT2 Q9NWW9 1/20 0.40
PLAAT4 Q9UL19 1/20 0.40

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
SCHEMBL19254537 1.00 NPC1 (0.49) NPC1RAB9APPARGPPARAALDH1A1
SCHEMBL15067896 1.00 NPC1 (0.49) NPC1RAB9APPARGPPARAALDH1A1
SCHEMBL15066402 0.88 SMN1; SMN2 (0.42) NPC1RAB9AALDH1A1MEN1KMT2A
SCHEMBL15066992 0.82 AKR1B1 (0.46) NPC1RAB9AALDH1A1KMT2ASMN1; SMN2
SCHEMBL15066568 0.81 HDAC8 (0.45) ALDH1A1MEN1KMT2A
SCHEMBL28045857 0.80 SMN1; SMN2 (0.49) NPC1RAB9APPARGPPARAALDH1A1
SCHEMBL9480324 0.78 IDO1 (0.50) NPC1RAB9APPARGPPARASMN1; SMN2
SCHEMBL28320994 0.78 NPC1 (0.47) NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL28322144 0.78 HPGD (0.41) NPC1RAB9APPARGPPARAALDH1A1
SCHEMBL2636331 0.78 TRPA1 (0.50) NPC1RAB9A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105189450-A Phenyl carbamate compound and composition for preventing or treating mental disorder comprising the same BIO PHARM SOLUTIONS CO LTD 2015-12-23 CN claimed
CN-105189450-B Phenyl carbamate compound and composition for preventing or treating mental disorder comprising the same 比皮艾思药物研发有限公司 2019-09-13 CN disclosed
CN-105189450-A Phenyl carbamate compound and composition for preventing or treating mental disorder comprising the same BIO PHARM SOLUTIONS CO LTD 2015-12-23 CN disclosed