SCHEMBL8014334

SCHEMBL8014334

COC(=O)c1ccc(Sc2cc3c(cc2C)C(C)(C)CCC3(C)C)c(C)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 15/20 0.60
RXRB P28702 9/20 0.60
RXRG P48443 9/20 0.60
CYP3A4 P08684 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
LMNA P02545 2/20 0.47
MAPT P10636 2/20 0.47
HPGD P15428 2/20 0.47
ALOX15 P16050 2/20 0.47
HSD17B10 Q99714 2/20 0.47
TP53 P04637 1/20 0.47
ALOX12 P18054 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
RARA P10276 2/20 0.45
RARB P10826 2/20 0.45
RARG P13631 2/20 0.45

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
SCHEMBL7723496 0.85 RXRA (0.76) RXRARXRBRXRGMEN1KMT2A
SCHEMBL22838103 0.80 RXRA (0.51) RXRARXRBRXRGCYP3A4MEN1
SCHEMBL9279961 0.79 RXRA (0.56) RXRARXRBRXRGCYP3A4MEN1
SCHEMBL2788640 0.77 CYP3A4 (0.70) RXRARXRBRXRGCYP3A4MEN1
SCHEMBL3982018 0.76 RXRA (0.72) RXRARXRBRXRGCYP3A4MEN1
SCHEMBL8015924 0.75 RXRA (0.71) RXRARXRBRXRGRARARARB
SCHEMBL1073307 0.75 RXRA (1.00) RXRARXRBRXRGMEN1KMT2A
SCHEMBL6901737 0.74 RXRA (0.61) RXRARXRBRXRGCYP3A4MEN1
SCHEMBL6907114 0.74 RXRA (0.76) RXRARXRBRXRGCYP3A4MEN1
SCHEMBL8014387 0.74 RXRA (0.78) RXRARXRBRXRGMEN1KMT2A

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-6162815-A RXR-agonist polycyclic aromatic compounds, pharmaceutical/cosmetic compositions comprising said compound and uses thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 2000-12-19 US disclosed
US-6156788-A Polycyclic aromatic compounds and pharmaceutical/cosmetic compositions comprised thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 2000-12-05 US disclosed
US-6015569-A PYRIDINE OR PYRROLE DERIVATIVES OF POLYCYCLIC AROMATICS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 2000-01-18 US disclosed
US-5766610-A USEFUL FOR TREATMENT OF MAMMALIAN SKIN AND HAIR, RHEUMATISM, RESIPIRATORY SYSTEM DISORDER, CARDIOVASCULAR AND VISION DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1998-06-16 US disclosed