SCHEMBL12394338

SCHEMBL12394338

COc1ccc(C(=O)Nc2ccccc2)cc1-c1ccc(C(=O)Nc2ccc(CN3CCCCC3)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.62
▸ KMT2A Q03164 3/20 0.60
▸ MAPT P10636 3/20 0.60
▸ SMN1; SMN2 Q16637 3/20 0.60
▸ ALDH1A1 P00352 2/20 0.60
▸ HSD17B10 Q99714 2/20 0.60
▸ HPGD P15428 2/20 0.60
▸ USP2 O75604 1/20 0.60
▸ MCHR1 Q99705 4/20 0.58
▸ TRPV1 Q8NER1 2/20 0.58
▸ HTT P42858 2/20 0.56
▸ RAB9A P51151 2/20 0.56
▸ KDM4E B2RXH2 1/20 0.56
▸ NPC1 O15118 1/20 0.56
▸ TNF P01375 1/20 0.56
▸ GAA P10253 1/20 0.55
▸ HIF1A Q16665 1/20 0.53
▸ EPAS1 Q99814 1/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.53

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
SCHEMBL694950 0.80 RAB9A (0.73) LMNAKMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL2915189 0.79 LMNA (0.54) LMNAKMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL28248353 0.79 KMT2A (0.80) LMNAKMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL12394335 0.79 KMT2A (0.62) LMNAKMT2ASMN1; SMN2ALDH1A1TRPV1
SCHEMBL14345137 0.77 PKM (0.58) LMNAKMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL5209151 0.77 RAB9A (0.64) LMNAKMT2AMAPTSMN1; SMN2HPGD
SCHEMBL17731943 0.77 LMNA (1.00) LMNAKMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL22501883 0.77 POLB (0.74) LMNAKMT2AMAPTALDH1A1HSD17B10
SCHEMBL17270179 0.76 ACKR3 (0.74) LMNAKMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL12394254 0.76 PKM (0.62) LMNAKMT2AMAPTSMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8008303-B2 e.g. 6-Methyl-biphenyl-3,4'-dicarboxylic acid 4'-[(3-bromo-phenyl)-amide]-[(4 morpholin-4-yl-phenyl)-amide]; viricide; with other active viricide such as interferon or ribavirin ASTRAZENECA AB (SE) 2011-08-30 — — US disclosed
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