SCHEMBL13634628

SCHEMBL13634628

Cc1ccccc1C(=O)N[C@H]1CCOC1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.64
RAB9A P51151 2/20 0.64
SMN1; SMN2 Q16637 2/20 0.61
GLA P06280 1/20 0.57
POLB P06746 3/20 0.52
KMT2A Q03164 5/20 0.50
MEN1 O00255 3/20 0.50
ALDH1A1 P00352 2/20 0.50
ALOX15 P16050 1/20 0.49
GAA P10253 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
NAMPT P43490 2/20 0.47
FASN P49327 1/20 0.47

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
SCHEMBL13162643 1.00 NPC1 (0.64) NPC1RAB9ASMN1; SMN2GLAPOLB
SCHEMBL13162693 0.91 NPC1 (0.72) NPC1RAB9ASMN1; SMN2GLAPOLB
SCHEMBL29062256 0.89 TAS1R3 (0.54) NPC1RAB9ASMN1; SMN2GLAPOLB
SCHEMBL13162654 0.88 NPC1 (0.67) NPC1RAB9ASMN1; SMN2GLAPOLB
SCHEMBL27171970 0.84 CNR2 (0.49) NPC1RAB9ASMN1; SMN2ALDH1A1GAA
SCHEMBL27204928 0.84 CNR2 (0.49) NPC1RAB9ASMN1; SMN2ALDH1A1GAA
SCHEMBL457993 0.82 NPC1 (0.84) NPC1RAB9ASMN1; SMN2GLAPOLB
SCHEMBL28949389 0.82 CRBN (0.48) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL13162036 0.81 NAMPT (0.50) NPC1RAB9ASMN1; SMN2NAMPTFASN
SCHEMBL13162009 0.81 NAMPT (0.50) NPC1RAB9ASMN1; SMN2NAMPTFASN

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
EP-2206707-B1 AZOLECARBOXAMIDE COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC (JP) 2014-07-23 EP disclosed
US-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 US disclosed
US-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 US disclosed