SCHEMBL7935542

SCHEMBL7935542

Cc1ccc(-c2c(C)cccc2/C=C/I)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NFE2L2 Q16236 2/20 0.33
▸ HSD17B1 P14061 1/20 0.33
▸ HSD17B2 P37059 1/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ SRC P12931 1/20 0.33
▸ TSHR P16473 1/20 0.32
▸ PTPN11 Q06124 1/20 0.32
▸ PTGS2 P35354 1/20 0.31
▸ RPA1 P27694 1/20 0.31
▸ MCL1 Q07820 1/20 0.31
▸ FABP4 P15090 1/20 0.31
▸ ADORA3 P0DMS8 1/20 0.31
▸ FGF23 Q9GZV9 1/20 0.31
▸ GRIA1 P42261 1/20 0.31
▸ CACNG8 Q8WXS5 1/20 0.31
▸ KIF11 P52732 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ LMNA P02545 1/20 0.31

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
SCHEMBL7935546 1.00 NFE2L2 (0.33) NFE2L2HSD17B1HSD17B2ALDH1A1KMT2A
SCHEMBL1044029 0.77 ACHE (0.44) ALDH1A1SRCTSHRADORA3GRIA1
SCHEMBL7935194 0.77 ALDH1A1 (0.54) HSD17B1HSD17B2ALDH1A1KMT2ATSHR
SCHEMBL7931850 0.76 NFE2L2 (0.37) NFE2L2ALDH1A1KMT2APOLBTSHR
SCHEMBL7931856 0.76 NFE2L2 (0.37) NFE2L2ALDH1A1KMT2APOLBTSHR
SCHEMBL7931959 0.76 NFE2L2 (0.38) NFE2L2ALDH1A1KMT2APOLBFGF23
SCHEMBL7931961 0.76 NFE2L2 (0.38) NFE2L2ALDH1A1KMT2APOLBFGF23
SCHEMBL19380349 0.73 ALDH1A1 (0.52) ALDH1A1KMT2APOLBTSHRPTGS2
SCHEMBL9681003 0.70 CD44 (0.50) ALDH1A1SRCTSHRGRIA1CACNG8
SCHEMBL3355657 0.70 ENPP1 (0.42) KMT2APTGS2ADORA3MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0879814-B1 Triaromatic compounds, compositions containing them and uses thereof CT INTERNAT DE BR RECH S DERMA (FR) 2001-11-28 — — EP disclosed
US-6150413-A TREATMENT OF DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR, BONE AND OPHTHALMOLOGICAL DISORDERS, AS WELL AS MAMMALIAN SKIN AND HAIR CONDITIONS; 4-(4-(BIPHENYL-2-YL)BUT-3-EN-1-YNYL)BENZOIC ACID, FOR EXAMPLE CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (FR) 2000-11-21 — — US disclosed
EP-0879814-A1 Triaromatic compounds, compositions containing them and uses thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (C.I.R.D. GALDERMA) (FR) 1998-11-25 — — EP disclosed
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