SCHEMBL7759700

SCHEMBL7759700

CC(c1c[c]ccc1)c1ccc2c(c1)C(C)(C)CCC2(C)C

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RXRA P19793 9/20 0.53
RXRB P28702 6/20 0.53
RARB P10826 12/20 0.38
RARG P13631 11/20 0.38
RARA P10276 9/20 0.38
CYP26A1 O43174 3/20 0.36
CYP3A4 P08684 3/20 0.36
CYP26B1 Q9NR63 1/20 0.36
RXRG P48443 4/20 0.33
PSEN1 P49768 1/20 0.32
PSEN2 P49810 1/20 0.32
SPPL2A Q8TCT8 1/20 0.32
APH1B Q8WW43 1/20 0.32
NCSTN Q92542 1/20 0.32
APH1A Q96BI3 1/20 0.32
PSENEN Q9NZ42 1/20 0.32
CRABP2 P29373 1/20 0.31

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
SCHEMBL7759792 0.82 RXRA (0.70) RXRARXRBRARBRARGRARA
SCHEMBL7759752 0.81 RXRA (0.54) RXRARXRBRARBRARGRARA
SCHEMBL7756674 0.74 RXRA (0.50) RXRARXRBRARBRARGRARA
SCHEMBL3175854 0.72 RXRA (0.57) RXRARXRBRARBRARGRARA
SCHEMBL7760189 0.72 RXRA (0.78) RXRARXRBRARBRARGRARA
SCHEMBL7761224 0.71 RXRA (0.54) RXRARXRBRARBRARGRARA
SCHEMBL3151286 0.70 KMT2A (0.36)
SCHEMBL3541162 0.70 RXRA (0.58) RXRARXRBRARBRARGRARA
SCHEMBL11240964 0.70 RXRA (0.54) RXRARXRBRARBRARGRARA
SCHEMBL7422602 0.70 RXRA (1.00) RXRARXRBRARBRARGRARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0915823-B1 BI-AROMATIC COMPOUNDS, PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME AND USES CT INTERNAT DE (FR) 2001-04-18 EP disclosed