SCHEMBL10508182

SCHEMBL10508182

Nc1ccccc1NOCC1CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.47
▸ KDM4E B2RXH2 4/20 0.47
▸ GAA P10253 4/20 0.47
▸ HDAC2 Q92769 9/20 0.38
▸ HDAC1 Q13547 8/20 0.38
▸ HDAC3 O15379 8/20 0.38
▸ MEN1 O00255 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ TP53 P04637 1/20 0.35
▸ APP P05067 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ SNCA P37840 1/20 0.35
▸ BLM P54132 1/20 0.35

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
SCHEMBL11699661 0.73 ALDH1A1 (0.45) MAPTKDM4EGAAHDAC2HDAC1
SCHEMBL11500098 0.73 PTGIR (0.43) RIPK1
SCHEMBL24755747 0.72 MAPT (0.41) MAPTKDM4EGAAHDAC2HDAC1
SCHEMBL977627 0.72 PTGER4 (0.47) MAPTKDM4EGAAHDAC2HDAC1
SCHEMBL30693377 0.72 PTGER4 (0.47) MAPTKDM4EGAAHDAC2HDAC1
SCHEMBL5487812 0.70 HDAC3 (0.40) MAPTKDM4EGAAHDAC2HDAC1
SCHEMBL29938610 0.69 HPGD (0.54) MAPTKDM4EGAAALDH1A1LMNA
SCHEMBL15846026 0.68 KDM4E (0.54) KDM4EGAAALDH1A1KMT2ALMNA
SCHEMBL3798519 0.68 ALDH1A1 (0.53) ALDH1A1LMNACYP1A2CYP2C9CYP2C19
SCHEMBL23493020 0.68 ALDH1A1 (0.53) ALDH1A1LMNACYP1A2CYP2C9CYP2C19

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
JP-1056666-A — — None — — JP disclosed
JP-S6456666-A CYCLOPROPYLMETHOXY-2-MERCAPTOBENZIMIDAZOLE AND PRODUCTION THEREOF TOKYO TANABE CO 1989-03-03 — — JP disclosed
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