SCHEMBL7929309

SCHEMBL7929309

O=C(O)c1ccc(C#C/C=C/c2ccccc2-c2ccc(F)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.45
BAD Q92934 1/20 0.45
RARB P10826 7/20 0.41
RARA P10276 6/20 0.41
RARG P13631 6/20 0.41
RXRA P19793 2/20 0.41
MAP4K4 O95819 1/20 0.38
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
MMP2 P08253 1/20 0.36
MMP9 P14780 1/20 0.36
MMP12 P39900 1/20 0.36
GCGR P47871 1/20 0.36
MAPK14 Q16539 1/20 0.36
TTR P02766 1/20 0.35
RXRB P28702 1/20 0.35
RXRG P48443 1/20 0.35
NR4A2 P43354 1/20 0.35
SLC6A4 P31645 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
SCHEMBL6479998 0.91 RARB (0.44) RARBRARARARGRXRARXRB
SCHEMBL7928924 0.91 RARB (0.44) RARBRARARARGRXRARXRB
SCHEMBL6473734 0.91 RARB (0.44) RARBRARARARGRXRARXRB
SCHEMBL7931791 0.89 BACE1 (0.44) RARBRARARARGRXRAKMT2A
SCHEMBL1683992 0.88 RARB (0.53) RARBRARARARGRXRAMAP4K4
SCHEMBL7922675 0.88 RARB (0.46) RARBRARARARGRXRAKMT2A
SCHEMBL7922764 0.88 ALOX15 (0.41) RARBRARARARGRXRAMAP4K4
SCHEMBL1683993 0.88 RARB (0.53) RARBRARARARGRXRAMAP4K4
SCHEMBL7922763 0.88 ALOX15 (0.41) RARBRARARARGRXRAMAP4K4
SCHEMBL7932612 0.87 CYP2C8 (0.46) RARBRARARARGRXRAMAP4K4

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