SCHEMBL9795608

SCHEMBL9795608

Cc1cc(C)cc(N2CC(=O)NC(=O)N2)c1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 5/20 0.40
MAPT P10636 3/20 0.37
HSD17B10 Q99714 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HSP90AA1 P07900 1/20 0.37
CCR6 P51684 1/20 0.37
NPSR1 Q6W5P4 2/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.35
PKM P14618 1/20 0.33

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
SCHEMBL9795641 0.83 ALOX5 (0.60) ALOX5MAPTHSD17B10L3MBTL1HSP90AA1
SCHEMBL9795754 0.82 ALOX5 (0.54) ALOX5MAPTLMNAPKM
SCHEMBL9795544 0.79 ALOX5 (0.56) ALOX5MAPTALDH1A1
SCHEMBL9795652 0.78 ADRB1 (0.40) ALOX5MAPTHSD17B10NPSR1ALDH1A1
SCHEMBL9795750 0.74 ALOX5 (0.35) ALOX5MAPTPKM
SCHEMBL9795683 0.72 CMA1 (0.36) ALOX5MAPTL3MBTL1ALDH1A1LMNA
SCHEMBL9644582 0.71 ALOX5 (0.71) ALOX5
SCHEMBL9795576 0.71 ALOX5 (0.54) ALOX5ALDH1A1LMNA
SCHEMBL9795690 0.71 ALOX5 (0.40) ALOX5MAPTALDH1A1PKM
SCHEMBL9795578 0.71 MMP13 (0.40) ALOX5HSD17B10NPSR1

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
US-5023255-A Triazine derivatives; inhibitors exzyme 5-lipoxygenase GLAXO GROUP LIMITED (GB) 1991-06-11 US disclosed
EP-0388165-A2 Chemical compounds GLAXO GROUP LIMITED (GB) 1990-09-19 EP disclosed