SCHEMBL7930707

SCHEMBL7930707

Cc1ccc(-c2ccc(O)cc2/C=C/C#Cc2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 8/20 0.51
RARA P10276 7/20 0.51
RARG P13631 7/20 0.51
RXRA P19793 2/20 0.43
ALDH1A1 P00352 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAP4K4 O95819 1/20 0.39
HSD17B1 P14061 1/20 0.39
BACE1 P56817 1/20 0.37
RXRB P28702 1/20 0.37
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
ESR2 Q92731 1/20 0.36
SRD5A2 P31213 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA9 Q16790 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
SCHEMBL2909227 0.92 RARB (0.53) RARBRARARARGRXRAALDH1A1
SCHEMBL2909230 0.92 RARB (0.53) RARBRARARARGRXRAALDH1A1
SCHEMBL7931861 0.91 RARB (0.51) RARBRARARARGRXRAALDH1A1
SCHEMBL8176699 0.88 TDP1 (0.43) RARBRARARARGALDH1A1SMN1; SMN2
SCHEMBL7922671 0.86 RARB (0.48) RARBRARARARGRXRAALDH1A1
SCHEMBL7929284 0.85 RARB (0.53) RARBRARARARGRXRAALDH1A1
SCHEMBL1683992 0.85 RARB (0.53) RARBRARARARGRXRAALDH1A1
SCHEMBL7931894 0.85 RARB (0.53) RARBRARARARGRXRAALDH1A1
SCHEMBL1683993 0.85 RARB (0.53) RARBRARARARGRXRAALDH1A1
SCHEMBL7922650 0.81 PTPN11 (0.47) RARBRARARARGRXRAALDH1A1

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 5 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 claimed
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 claimed
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