SCHEMBL257935

SCHEMBL257935

Cc1ccc(OC(C(=O)N2CCCCC2)c2ccccc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRM1 P11229 1/20 0.65
▸ LTB4R Q15722 1/20 0.49
▸ LTB4R2 Q9NPC1 1/20 0.49
▸ MAPK1 P28482 1/20 0.46
▸ HPGD P15428 4/20 0.45
▸ KMT2A Q03164 3/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ TSHR P16473 2/20 0.43
▸ NPSR1 Q6W5P4 3/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ ALOX15 P16050 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42

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
SCHEMBL12260830 0.86 CHRM1 (0.61) CHRM1LTB4RLTB4R2MAPK1HPGD
SCHEMBL10269556 0.84 CHRM1 (0.59) CHRM1LTB4RLTB4R2MAPK1HPGD
SCHEMBL13865331 0.80 CHRM1 (0.55) CHRM1MAPK1HPGDKMT2AALDH1A1
SCHEMBL21907373 0.78 CHRM1 (0.56) CHRM1MAPK1HPGDKMT2AALDH1A1
SCHEMBL8935862 0.78 KDM4E (0.52) CHRM1HPGDKMT2AALDH1A1MEN1
SCHEMBL8935861 0.78 KDM4E (0.52) CHRM1HPGDKMT2AALDH1A1MEN1
SCHEMBL13324881 0.77 CHRM1 (0.60) CHRM1LTB4RLTB4R2MAPK1KMT2A
SCHEMBL13359378 0.77 CHRM1 (0.60) CHRM1LTB4RLTB4R2MAPK1KMT2A
SCHEMBL11363525 0.76 TSHR (0.63) CHRM1MAPK1KMT2AALDH1A1MEN1
SCHEMBL9044655 0.74 KMT2A (0.51) CHRM1HPGDKMT2AALDH1A1MEN1

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-2399585-A1 Boronic acids and esters as inhibitors of fatty acid amide hydrolase Infinity Pharmaceuticals, Inc. (US) 2011-12-28 — — EP disclosed
EP-2399584-A1 Boronic acids and esters as inhibitors of fatty acid amide hydrolase Infinity Pharmaceuticals, Inc. (US) 2011-12-28 — — EP disclosed
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