SCHEMBL7935210

SCHEMBL7935210

COCOc1cccc(C=O)c1-c1ccc(C)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ HPGD P15428 2/20 0.40
▸ HTT P42858 1/20 0.40
▸ TLR2 O60603 1/20 0.40
▸ ERN1 O75460 1/20 0.40
▸ TLR1 Q15399 1/20 0.40
▸ TLR6 Q9Y2C9 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.37
▸ PTPN1 P18031 1/20 0.37
▸ RAB9A P51151 3/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ MAPT P10636 1/20 0.36
▸ NFE2L2 Q16236 1/20 0.35
▸ DUSP3 P51452 1/20 0.35
▸ PTGDR2 Q9Y5Y4 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35

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
SCHEMBL7931856 0.83 NFE2L2 (0.37) ALDH1A1NPSR1PTPN1LMNAMAPT
SCHEMBL7931850 0.83 NFE2L2 (0.37) ALDH1A1NPSR1PTPN1LMNAMAPT
SCHEMBL7922716 0.83 ERN1 (0.53) SMN1; SMN2ALDH1A1HPGDTLR2ERN1
SCHEMBL22804095 0.79 TLR2 (0.50) SMN1; SMN2ALDH1A1HPGDHTTTLR2
SCHEMBL7929267 0.77 SYK (0.39) SMN1; SMN2ALDH1A1HTTERN1PTPN1
SCHEMBL1243967 0.76 ALDH1A1 (0.68) SMN1; SMN2ALDH1A1HPGDHTTTLR2
SCHEMBL3214106 0.75 ALDH1A1 (0.47) SMN1; SMN2ALDH1A1HPGDHTTTLR2
SCHEMBL7935194 0.74 ALDH1A1 (0.54) SMN1; SMN2ALDH1A1TLR2ERN1TLR1
SCHEMBL23633015 0.74 ALDH1A1 (0.46) SMN1; SMN2ALDH1A1HPGDHTTTLR2
SCHEMBL4683638 0.74 CA1 (0.53) SMN1; SMN2ALDH1A1HPGDHTTTLR2

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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