SCHEMBL9866232

SCHEMBL9866232

Clc1cnc2nc(-c3ccco3)oc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.49
ALDH1A1 P00352 8/20 0.47
KDM4E B2RXH2 7/20 0.47
HPGD P15428 7/20 0.47
HSD17B10 Q99714 6/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
CASP3 P42574 2/20 0.47
ADORA2A P29274 2/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
MAPT P10636 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
TP53 P04637 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
LMNA P02545 4/20 0.40
GAA P10253 1/20 0.40
HTT P42858 1/20 0.40
PIK3R1 P27986 2/20 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
SCHEMBL9868107 0.75 ALOX5 (0.58) ALOX5ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL9868637 0.75 SMN1; SMN2 (0.45) ALDH1A1KDM4EHPGDHSD17B10NPC1
SCHEMBL9867554 0.75 NPC1 (0.50) ALDH1A1KDM4EHPGDHSD17B10NPC1
SCHEMBL30943969 0.74 LPL (0.48) ALOX5ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL9867347 0.72 KDM4E (0.61) ALDH1A1KDM4EHPGDHSD17B10NPC1
SCHEMBL6233715 0.72 PIK3R1 (0.63) ALDH1A1KDM4EHPGDHSD17B10RAB9A
SCHEMBL31631303 0.71 NPC1 (0.64) ALDH1A1KDM4EHPGDHSD17B10NPC1
SCHEMBL25028312 0.71 ALOX5 (0.71) ALOX5ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL30648212 0.70 CHRNA7 (0.47) ALDH1A1HPGDHSD17B10NPC1RAB9A
SCHEMBL27075892 0.70 CHRNA7 (0.47) ALDH1A1HPGDHSD17B10NPC1RAB9A

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
US-5077408-A PROCESS FOR THE SYNTHESIS OF OXAZOLOPYRIDINE COMPOUNDS SCIENCE ET ORGANISATION (FR) 1991-12-31 US disclosed