SCHEMBL7348235

SCHEMBL7348235

Nc1ccc2[nH]c(CC(=O)O)nc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.53
ALDH1A1 P00352 3/20 0.53
KDM4E B2RXH2 5/20 0.45
PKM P14618 3/20 0.45
TDP1 Q9NUW8 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
SMN1; SMN2 Q16637 4/20 0.44
RAB9A P51151 2/20 0.44
GAA P10253 1/20 0.44
RAD52 P43351 1/20 0.44
CHRM1 P11229 1/20 0.44
MAPKAPK2 P49137 1/20 0.44
RPS6KA3 P51812 1/20 0.44
CSNK2A1 P68400 1/20 0.44
PLK3 Q9H4B4 1/20 0.44
LMNA P02545 2/20 0.43
PRKAG1 P54619 1/20 0.42
PRKAA2 P54646 1/20 0.42

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
SCHEMBL7348242 0.88 MAPT (0.68) MAPTALDH1A1KDM4EPKMTDP1
SCHEMBL10891268 0.84 RAD52 (0.48) MAPTALDH1A1KDM4EPKMTDP1
SCHEMBL11780147 0.81 RAB9A (0.56) MAPTALDH1A1KDM4ETDP1MEN1
SCHEMBL3100859 0.81 RAB9A (0.52) MAPTALDH1A1KDM4ETDP1MEN1
SCHEMBL12596884 0.81 CHRM1 (0.44) MAPTALDH1A1KDM4ETDP1MEN1
SCHEMBL38661019 0.81 RAB9A (0.56) MAPTALDH1A1KDM4ETDP1MEN1
SCHEMBL9513404 0.81 TSHR (0.47) MAPTALDH1A1KDM4ETDP1SMN1; SMN2
SCHEMBL7357580 0.80 HSD17B10 (0.67) MAPTALDH1A1KDM4EPKMMEN1
SCHEMBL3947749 0.80 RAD52 (0.53) MAPTALDH1A1KDM4EPKMTDP1
Hydrochloric Acid SCHEMBL5111382 0.80 RAB9A (0.51) MAPTALDH1A1KDM4ETDP1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5741804-A Substituted benzimazoles which inhibit platelet aggrecation SMITHKLINE BEECHAM CORPORATION (US) 1998-04-21 US disclosed
EP-0672034-A4 BENZIMIDAZOLE COMPOUNDS WHICH INHIBIT PLATELET AGGREGATION. SMITHKLINE BEECHAM CORP (US) 1996-09-25 EP disclosed
EP-0672034-A1 BENZIMIDAZOLE COMPOUNDS WHICH INHIBIT PLATELET AGGREGATION SMITHKLINE BEECHAM CORPORATION (US) 1995-09-20 EP disclosed
WO-1994012478-A1 BENZIMIDAZOLE COMPOUNDS WHICH INHIBIT PLATELET AGGREGATION SMITHKLINE BEECHAM CORPORATION (US) 1994-06-09 WO disclosed