SCHEMBL9689326

SCHEMBL9689326

COc1ccc(C(=O)c2cccn2CCCl)cc1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
PPARG P37231 2/20 0.50
PPARA Q07869 2/20 0.50
ALDH1A1 P00352 2/20 0.50
LMNA P02545 2/20 0.50
ALOX15 P16050 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
HPGD P15428 1/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
MAPT P10636 1/20 0.46
ALOX12 P18054 1/20 0.46
RECQL P46063 1/20 0.46
HTT P42858 1/20 0.44
CYP19A1 P11511 1/20 0.43

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
SCHEMBL9690056 0.86 RAB9A (0.54) NPC1RAB9APPARGPPARAALDH1A1
SCHEMBL9689136 0.86 NPC1 (0.54) NPC1RAB9APPARGPPARAALDH1A1
SCHEMBL9688818 0.82 RECQL (0.66) NPC1RAB9AALDH1A1LMNAKMT2A
SCHEMBL9687969 0.81 NPC1 (0.52) NPC1RAB9APPARGPPARAALDH1A1
SCHEMBL2723083 0.80 PPARG (0.57) NPC1RAB9APPARGPPARAALDH1A1
SCHEMBL6957332 0.79 RAB9A (0.50) NPC1RAB9AALDH1A1LMNAALOX15
SCHEMBL9688014 0.79 NPC1 (0.47) NPC1RAB9APPARGPPARAALDH1A1
SCHEMBL9688779 0.78 RECQL (0.46) NPC1RAB9APPARGPPARAALDH1A1
SCHEMBL9688851 0.76 NPSR1 (0.48) NPC1RAB9APPARGPPARAALDH1A1
SCHEMBL9689070 0.76 SMN1; SMN2 (0.48) NPC1RAB9AALDH1A1LMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0486807-A1 Process for preparing 5-aroyl-2,3-dihydro-1H-pyrrolizine-1,1-dicarboxylates SYNTEX (U.S.A.) INC. (US) 1992-05-27 EP disclosed
US-5082951-A Process for preparing 5-aroyl-2,3-dihydro-1H-pyrrolizine-1,1-dicarboxylates (I) and intermediates therefor SYNTEX (U.S.A.) INC. (US) 1992-01-21 US disclosed