SCHEMBL1078296

SCHEMBL1078296

CCC(C(=O)NCc1ccc(N(C)C)cc1)N(c1ccccc1OC)S(=O)(=O)c1ccccc1C

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PTGER1 P34995 5/20 0.44
▸ ALDH1A1 P00352 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HPGD P15428 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ LMNA P02545 2/20 0.38
▸ POLB P06746 1/20 0.37
▸ CARM1 Q86X55 1/20 0.37
▸ PRMT6 Q96LA8 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.36

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
SCHEMBL1074513 0.88 PTGER1 (0.44) PTGER1ALDH1A1MEN1MAPTKMT2A
SCHEMBL1078165 0.85 PTGER1 (0.43) PTGER1ALDH1A1MAPTSMN1; SMN2HPGD
SCHEMBL1076164 0.84 ALDH1A1 (0.54) ALDH1A1KMT2AHSD17B10
SCHEMBL6199052 0.83 HIF1A (0.42) PTGER1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL1078008 0.81 KMT2A (0.43) PTGER1ALDH1A1MEN1MAPTKMT2A
SCHEMBL6203784 0.80 TDP1 (0.39) PTGER1MEN1KMT2AHPGDLMNA
SCHEMBL1078295 0.72 HCRTR2 (0.56) PTGER1MEN1KMT2A
SCHEMBL1076948 0.70 HCRTR1 (0.44) —
SCHEMBL6183374 0.67 HCRTR1 (0.45) —
SCHEMBL8337800 0.67 PTGER1 (0.62) PTGER1MEN1MAPTKMT2ASMN1; SMN2

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
EP-1554239-B1 SULFONYLAMINO-ACETIC ACID DERIVATIVES AND THEIR USE AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2011-01-26 — — EP disclosed
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