SCHEMBL9044733

SCHEMBL9044733

Cc1ccc2[nH]c(=O)n(CCC3CCN(Cc4ccccc4)CC3)c(=O)c2c1

nearest known ligand 0.77

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 9/20 0.77
▸ HSD17B10 Q99714 2/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ RXFP1 Q9HBX9 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ MAOB P27338 1/20 0.47

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
SCHEMBL9046220 0.87 ACHE (1.00) ACHEHSD17B10KDM4EHPGDALDH1A1
SCHEMBL10084674 0.84 HPGD (0.53) ACHEHSD17B10KDM4EHPGDALDH1A1
SCHEMBL9046728 0.82 ACHE (1.00) ACHEHSD17B10KDM4EHPGDHTT
SCHEMBL9046826 0.81 ACHE (0.87) ACHEHSD17B10KDM4EHPGDALDH1A1
SCHEMBL9261167 0.80 ACHE (0.56) ACHEHSD17B10HPGDALDH1A1
SCHEMBL10085009 0.80 KDM4E (0.68) KDM4EHPGDHTTALDH1A1KMT2A
SCHEMBL9411391 0.76 ACHE (0.58) ACHEALDH1A1MAOB
SCHEMBL10085640 0.75 HTR1D (0.51) ACHEHSD17B10KDM4EHPGDALDH1A1
SCHEMBL9411647 0.74 ACHE (0.53) ACHEKMT2AMAOB
SCHEMBL10085041 0.74 KDM4E (0.51) HSD17B10KDM4EHPGDALDH1A1KMT2A

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-0742216-A2 Cyclic amide derivatives Eisai Co., Ltd. (JP) 1996-11-13 — — EP claimed
EP-0742216-A2 Cyclic amide derivatives Eisai Co., Ltd. (JP) 1996-11-13 — — EP disclosed
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