SCHEMBL9302827

SCHEMBL9302827

CCOC(=O)c1ccc(Cc2nc3ccccc3[nH]2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.71
ALDH1A1 P00352 4/20 0.71
NPC1 O15118 3/20 0.71
RAB9A P51151 3/20 0.71
LMNA P02545 1/20 0.71
MAPK1 P28482 1/20 0.71
HSD17B10 Q99714 3/20 0.62
PKM P14618 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
HPGD P15428 1/20 0.59
GAA P10253 1/20 0.58
GRIN1 Q05586 1/20 0.56
GRIN2B Q13224 1/20 0.56
HDAC3 O15379 1/20 0.54
HDAC4 P56524 1/20 0.54
HDAC1 Q13547 1/20 0.54
HDAC7 Q8WUI4 1/20 0.54
HDAC2 Q92769 1/20 0.54
HDAC10 Q969S8 1/20 0.54
HDAC11 Q96DB2 1/20 0.54

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
SCHEMBL2878961 0.88 HSD17B10 (0.66) MAPTALDH1A1NPC1RAB9ALMNA
SCHEMBL9302971 0.86 MAPT (0.60) MAPTALDH1A1NPC1RAB9ALMNA
SCHEMBL6171495 0.85 GAA (0.59) MAPTALDH1A1NPC1RAB9ALMNA
SCHEMBL6171488 0.85 MAPT (0.56) MAPTALDH1A1NPC1RAB9ALMNA
SCHEMBL9303210 0.83 MAPT (0.59) MAPTALDH1A1NPC1RAB9ALMNA
SCHEMBL9304019 0.83 MAPT (0.59) MAPTALDH1A1NPC1RAB9ALMNA
SCHEMBL2881710 0.82 GAA (0.71) MAPTALDH1A1NPC1RAB9AHSD17B10
SCHEMBL9302580 0.82 ALDH1A1 (0.52) MAPTALDH1A1NPC1RAB9ALMNA
SCHEMBL9301949 0.82 GRIN1 (0.63) MAPTALDH1A1NPC1RAB9ALMNA
SCHEMBL9301797 0.82 RAB9A (0.58) MAPTALDH1A1NPC1RAB9ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5314880-A Platelet activating factor antagonist BRITISH BIO-TECHNOLOGY LIMITED (GB) 1994-05-24 US claimed
EP-0468971-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1992-02-05 EP claimed
WO-1990009997-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1990-09-07 WO claimed
US-5314880-A Platelet activating factor antagonist BRITISH BIO-TECHNOLOGY LIMITED (GB) 1994-05-24 US disclosed
EP-0468971-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1992-02-05 EP disclosed
WO-1990009997-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1990-09-07 WO disclosed