SCHEMBL8569632

SCHEMBL8569632

Cc1nc2c(NC(=O)c3c(Cl)cccc3Cl)cccc2[nH]1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.58
PTGES O14684 7/20 0.49
PARP1 P09874 1/20 0.48
MAOB P27338 1/20 0.45
ADORA2A P29274 1/20 0.45
ADORA2B P29275 1/20 0.45
ADORA1 P30542 1/20 0.45
RAB9A P51151 1/20 0.45
LMNA P02545 2/20 0.45
MEN1 O00255 1/20 0.45
POLB P06746 1/20 0.45
KMT2A Q03164 1/20 0.45
JAK2 O60674 2/20 0.44
JAK1 P23458 2/20 0.44
TYK2 P29597 2/20 0.44
MAPT P10636 2/20 0.43
CYP3A4 P08684 1/20 0.43
HPGD P15428 1/20 0.43
EPHB3 P54753 1/20 0.43
TSHR P16473 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
SCHEMBL8597761 0.84 PTGES (0.52) TRPV1PTGESMAOBADORA2AADORA2B
SCHEMBL8597518 0.84 PTGES (0.51) TRPV1PTGESMAOBADORA2AADORA2B
SCHEMBL8662196 0.83 PTGES (0.52) TRPV1PTGESMAOBADORA2AADORA2B
SCHEMBL8597015 0.82 MAOB (0.43) TRPV1PTGESPARP1MAOBADORA2A
SCHEMBL8600699 0.81 TRPV1 (0.43) TRPV1PTGESMAOBADORA2AADORA2B
SCHEMBL8599475 0.81 TRPV1 (0.65) TRPV1PTGESPARP1MAOBADORA2A
SCHEMBL20762474 0.80 PARP1 (0.55) TRPV1PARP1RAB9ALMNAMEN1
SCHEMBL8602009 0.78 PTGES (0.48) TRPV1PTGES
SCHEMBL8473813 0.76 RAB9A (0.47) PTGESRAB9ALMNAMEN1POLB
SCHEMBL8560232 0.76 TYK2 (0.52) PTGESPARP1RAB9AMEN1POLB

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-0863881-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE IN THE PREVENTION AND/OR THE TREATMENT OF BONE DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-09-16 EP disclosed
WO-1997010219-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE IN THE PREVENTION AND/OR THE TREATMENT OF BONE DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-03-20 WO disclosed