SCHEMBL7356370

SCHEMBL7356370

NN=C(C(=O)OCc1ccccc1)c1ccc(N)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.49
NPC1 O15118 3/20 0.49
LMNA P02545 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A3 Q01959 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 5/20 0.44
L3MBTL1 Q9Y468 2/20 0.42
MAPT P10636 2/20 0.42
MAPK1 P28482 1/20 0.42
GAA P10253 1/20 0.42
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA9 Q16790 2/20 0.42
HPGD P15428 1/20 0.41

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
SCHEMBL7353946 0.90 NR4A1 (0.51) LMNASLC6A2SLC6A3KMT2ATDP1
SCHEMBL21187890 0.81 RAB9A (0.54) RAB9ANPC1LMNASLC6A2SLC6A3
SCHEMBL27400296 0.81 ALDH1A1 (0.55) RAB9ANPC1LMNASLC6A2SLC6A3
SCHEMBL1009228 0.78 KMT2A (0.76) RAB9ANPC1LMNASLC6A2SLC6A3
SCHEMBL8402406 0.78 ALDH1A1 (0.59) LMNASLC6A2SLC6A3KMT2ATDP1
Hydrochloric Acid SCHEMBL2146029 0.76 KMT2A (0.73) RAB9ANPC1LMNASLC6A2SLC6A3
SCHEMBL22363574 0.74 RAB9A (0.47) RAB9ANPC1LMNASLC6A2SLC6A3
SCHEMBL27400293 0.74 ALDH1A1 (0.55) RAB9ANPC1LMNASLC6A2SLC6A3
SCHEMBL22080438 0.74 KMT2A (0.69) RAB9ANPC1LMNASLC6A2SLC6A3
SCHEMBL7399817 0.73 RAB9A (0.49) RAB9ANPC1LMNASLC6A2SLC6A3

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