SCHEMBL7623671

SCHEMBL7623671

O=[N+]([O-])c1ccc2[nH]c(C=Cc3ccncc3)nc2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 7/20 0.67
▸ KMT2A Q03164 7/20 0.67
▸ LMNA P02545 4/20 0.67
▸ RAB9A P51151 7/20 0.61
▸ MAPT P10636 7/20 0.61
▸ NPC1 O15118 6/20 0.61
▸ HTT P42858 2/20 0.61
▸ NPSR1 Q6W5P4 1/20 0.61
▸ MCL1 Q07820 1/20 0.59
▸ PTK2B Q14289 1/20 0.59
▸ SNCA P37840 1/20 0.49
▸ PKN1 Q16512 1/20 0.48
▸ PKN2 Q16513 1/20 0.48
▸ ALDH1A1 P00352 4/20 0.46
▸ KDM4E B2RXH2 2/20 0.43
▸ PKM P14618 2/20 0.43
▸ HPGD P15428 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ HSP90AA1 P07900 1/20 0.43
▸ TDP1 Q9NUW8 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
SCHEMBL7623659 1.00 MEN1 (0.67) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL7801907 0.83 MEN1 (0.65) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL7801910 0.83 MEN1 (0.65) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL7631067 0.81 MEN1 (0.59) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL7631055 0.81 MEN1 (0.59) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL7621052 0.79 PTGS2 (0.62) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL7621043 0.79 PTGS2 (0.62) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL22075782 0.78 MEN1 (0.53) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL30343723 0.76 NPC1 (0.80) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL14447534 0.76 NPC1 (0.80) 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 7 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-A1 STYRYL BENZIMIDAZOLE DERIVATIVES AS INHIBITORS OF SMOOTH MUSCLE CELL PROLIFERATION AMERICAN HOME PRODUCTS CORPORATION (US) 1998-03-25 — — EP claimed
WO-1996039391-A1 STYRYL BENZIMIDAZOLE DERIVATIVES AS INHIBITORS OF SMOOTH MUSCLE CELL PROLIFERATION AMERICAN HOME PRODUCTS CORPORATION (US) 1996-12-12 — — WO claimed
US-6444694-B1 ANTIPROLIFERATIVE AGENTS WYETH 2002-09-03 — — US disclosed
EP-0830345-B1 STYRYL BENZIMIDAZOLE DERIVATIVES AS INHIBITORS OF SMOOTH MUSCLE CELL PROLIFERATION AMERICAN HOME PROD (US) 2001-09-05 — — EP disclosed
EP-0830345-A1 STYRYL BENZIMIDAZOLE DERIVATIVES AS INHIBITORS OF SMOOTH MUSCLE CELL PROLIFERATION AMERICAN HOME PRODUCTS CORPORATION (US) 1998-03-25 — — EP disclosed
WO-1996039391-A1 STYRYL BENZIMIDAZOLE DERIVATIVES AS INHIBITORS OF SMOOTH MUSCLE CELL PROLIFERATION AMERICAN HOME PRODUCTS CORPORATION (US) 1996-12-12 — — WO disclosed
Send feedback