SCHEMBL7350953

SCHEMBL7350953

Cc1c(CCC(=O)O)[nH]c2ccc(C(=O)OCc3ccccc3)cc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 2/20 0.50
RAB9A P51151 6/20 0.49
KMT2A Q03164 4/20 0.49
ALDH1A1 P00352 4/20 0.49
MAPT P10636 4/20 0.49
MEN1 O00255 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
KDM4E B2RXH2 2/20 0.49
ALOX5 P09917 1/20 0.47
TUBB4A P04350 1/20 0.46
TUBB P07437 1/20 0.46
TUBA3C P0DPH7 1/20 0.46
TUBA1B P68363 1/20 0.46
TUBA4A P68366 1/20 0.46
TUBB4B P68371 1/20 0.46
TUBB3 Q13509 1/20 0.46
TUBB2A Q13885 1/20 0.46
TUBB8 Q3ZCM7 1/20 0.46
TUBA3E Q6PEY2 1/20 0.46
TUBA1A Q71U36 1/20 0.46

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
SCHEMBL7348472 0.81 APEX1 (0.62) HCRTR1KMT2AALDH1A1MAPTMEN1
SCHEMBL8324520 0.77 MEN1 (0.57) HCRTR1RAB9AKMT2AALDH1A1MAPT
SCHEMBL11134825 0.77 ALDH1A1 (0.71) HCRTR1RAB9AKMT2AALDH1A1MAPT
SCHEMBL28900980 0.75 KMT2A (0.61) RAB9AKMT2AALDH1A1MAPTMEN1
SCHEMBL21027368 0.74 ALDH1A1 (0.59) HCRTR1RAB9AKMT2AALDH1A1MAPT
SCHEMBL8318727 0.74 KDM4E (0.56) HCRTR1KMT2AALDH1A1MAPTMEN1
SCHEMBL5756220 0.73 EGFR (0.48) KMT2AMAPTMEN1APEX1FFAR4
SCHEMBL2161298 0.73 HCRTR1 (0.74) HCRTR1RAB9AKMT2AALDH1A1MAPT
SCHEMBL22074470 0.72 TRPM8 (0.54) KMT2AALDH1A1MAPTMEN1SMN1; SMN2
SCHEMBL27294399 0.72 HCRTR1 (0.58) HCRTR1RAB9AKMT2AALDH1A1MAPT

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