SCHEMBL7760266

SCHEMBL7760266

CCNC(=O)/C=C/c1cccc(C2(c3cc4c(cc3C)C(C)(C)CCC4(C)C)CC2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A19 Q695T7 1/20 0.49
RXRA P19793 6/20 0.47
OPRM1 P35372 1/20 0.39
OPRL1 P41146 1/20 0.39
RXRG P48443 4/20 0.39
RARG P13631 3/20 0.39
RXRB P28702 3/20 0.39
RARA P10276 2/20 0.39
RARB P10826 2/20 0.39
PPARG P37231 1/20 0.39
MMP1 P03956 2/20 0.38
MMP2 P08253 2/20 0.38
MMP9 P14780 2/20 0.38
BACE1 P56817 2/20 0.38
ALDH1A1 P00352 1/20 0.37
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 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
SCHEMBL7760270 1.00 SLC6A19 (0.49) SLC6A19RXRAOPRM1OPRL1RXRG
SCHEMBL7756556 0.88 SLC6A19 (0.51) SLC6A19RXRAOPRM1OPRL1RXRG
SCHEMBL7759674 0.88 SLC6A19 (0.51) SLC6A19RXRAOPRM1OPRL1RXRG
SCHEMBL7760238 0.85 RXRA (0.56) RXRARXRGRARGRXRBRARA
SCHEMBL7760236 0.85 RXRA (0.56) RXRARXRGRARGRXRBRARA
SCHEMBL7761535 0.84 RXRA (0.52) RXRARXRGRARGRXRBRARA
SCHEMBL7756568 0.84 RXRA (0.52) RXRARXRGRARGRXRBRARA
SCHEMBL7761196 0.83 MMP1 (0.53) RXRAMMP1MMP2MMP9BACE1
SCHEMBL7756565 0.83 MMP1 (0.53) RXRAMMP1MMP2MMP9BACE1
SCHEMBL7756591 0.81 RXRA (0.44) SLC6A19RXRARXRGRARGRXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6258775-B1 3-(3-(5,5,8,8-TETRAMATHYL-5,6,7,8-TETRAHYDRO-2-NAPHTYLCARBONYL )PHENYL)ACRYLIC ACID FOR TREATING DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR, AND OPHTHALMOLOGICAL DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 2001-07-10 US claimed
EP-0915823-B1 BI-AROMATIC COMPOUNDS, PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME AND USES CT INTERNAT DE (FR) 2001-04-18 EP claimed
US-6258775-B1 3-(3-(5,5,8,8-TETRAMATHYL-5,6,7,8-TETRAHYDRO-2-NAPHTYLCARBONYL )PHENYL)ACRYLIC ACID FOR TREATING DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR, AND OPHTHALMOLOGICAL DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 2001-07-10 US disclosed
EP-0915823-B1 BI-AROMATIC COMPOUNDS, PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME AND USES CT INTERNAT DE (FR) 2001-04-18 EP disclosed