SCHEMBL7801907

SCHEMBL7801907

COc1ccc(/C=C/c2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.65
▸ KMT2A Q03164 6/20 0.65
▸ LMNA P02545 4/20 0.65
▸ RAB9A P51151 5/20 0.60
▸ MAPT P10636 5/20 0.60
▸ NPC1 O15118 4/20 0.60
▸ HTT P42858 3/20 0.60
▸ NPSR1 Q6W5P4 1/20 0.60
▸ NFE2L2 Q16236 1/20 0.55
▸ MCL1 Q07820 1/20 0.55
▸ PTK2B Q14289 1/20 0.55
▸ PTGS2 P35354 2/20 0.52
▸ PTGS1 P23219 1/20 0.52
▸ GAA P10253 1/20 0.52
▸ NFKB1 P19838 1/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ STAT1 P42224 1/20 0.52
▸ NPBWR1 P48145 1/20 0.52
▸ NFKB2 Q00653 1/20 0.52
▸ RELA Q04206 1/20 0.52

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
SCHEMBL7801910 1.00 MEN1 (0.65) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL7621043 0.86 PTGS2 (0.62) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL7621052 0.86 PTGS2 (0.62) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL17890084 0.85 TUBB4A (0.65) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL17890087 0.85 TUBB4A (0.65) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL7623671 0.83 MEN1 (0.67) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL7623659 0.83 MEN1 (0.67) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL2244388 0.78 NPBWR1 (0.81) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL7631067 0.78 MEN1 (0.59) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL7631055 0.78 MEN1 (0.59) MEN1KMT2ALMNARAB9AMAPT

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-0830345-B1 STYRYL BENZIMIDAZOLE DERIVATIVES AS INHIBITORS OF SMOOTH MUSCLE CELL PROLIFERATION AMERICAN HOME PROD (US) 2001-09-05 — — EP claimed
EP-0830345-B1 STYRYL BENZIMIDAZOLE DERIVATIVES AS INHIBITORS OF SMOOTH MUSCLE CELL PROLIFERATION AMERICAN HOME PROD (US) 2001-09-05 — — EP disclosed
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