SCHEMBL9664286

SCHEMBL9664286

COn1c(-c2ccccc2)nc2cc(C(O)c3ccccc3)ccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.52
NPC1 O15118 1/20 0.52
CASP3 P42574 1/20 0.52
SENP8 Q96LD8 1/20 0.52
SENP7 Q9BQF6 1/20 0.52
SENP6 Q9GZR1 1/20 0.52
BACE1 P56817 1/20 0.45
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
ALDH1A1 P00352 2/20 0.40
PPARG P37231 1/20 0.40
NLRP3 Q96P20 1/20 0.39
BRD4 O60885 1/20 0.38
CREBBP Q92793 1/20 0.38
HPGD P15428 2/20 0.37
KDM4E B2RXH2 1/20 0.37
HSD17B10 Q99714 1/20 0.37
LMNA P02545 2/20 0.37
HTT P42858 2/20 0.37

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
SCHEMBL9663634 0.90 RAB9A (0.62) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL9663458 0.87 PPARG (0.39) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL9663713 0.76 RAB9A (0.45) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL3969472 0.76 RAB9A (0.68) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL9662276 0.75 ESRRA (0.48) RAB9ANPC1KMT2AMEN1MAPT
SCHEMBL16509203 0.71 RAB9A (0.74) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL8932716 0.69 CNR2 (0.33) KMT2APPARGLMNAHTTSMN1; SMN2
SCHEMBL26038761 0.69 RAB9A (1.00) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL9663826 0.68 HPGD (0.40) KMT2AMEN1MAPTALDH1A1PPARG
SCHEMBL9078481 0.67 GRM5 (0.52) RAB9ANPC1KMT2AMEN1MAPT

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-0260744-B1 (1H-IMIDAZOL-1-YLMETHYL) SUBSTITUTED BENZIMIDAZOLE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1992-12-16 EP disclosed
US-4859684-A (1H-imidazol-1-ylmethyl) substituted benzimidazole derivatives and use thereof in treating androgen dependent disorders JANSSEN PHARMACEUTICA N.V. (BE) 1989-08-22 US disclosed
EP-0260744-A2 (1H-imidazol-1-ylmethyl) substituted benzimidazole derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1988-03-23 EP disclosed