SCHEMBL8560240

SCHEMBL8560240

CCCOC(=O)C1=CCC(C)(C)c2ccc(C=COC(=O)c3ccccc3)cc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARA P10276 8/20 0.46
RARB P10826 7/20 0.46
RARG P13631 7/20 0.46
RXRA P19793 1/20 0.46
NR2E1 Q9Y466 1/20 0.46
LMNA P02545 1/20 0.43
ELANE P08246 3/20 0.35
POLB P06746 1/20 0.34
ALDH1A1 P00352 5/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
THRB P10828 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 1/20 0.32
APP P05067 1/20 0.32
ESR1 P03372 1/20 0.32
CHRM1 P11229 1/20 0.32
TSHR P16473 1/20 0.32
SLC6A2 P23975 1/20 0.32

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
Methane SCHEMBL8560238 0.91 RARA (0.47) RARARARBRARGRXRANR2E1
SCHEMBL8560234 0.85 RARA (0.50) RARARARBRARGRXRANR2E1
SCHEMBL8560231 0.85 RARA (0.50) RARARARBRARGRXRANR2E1
SCHEMBL6294009 0.84 RARA (0.60) RARARARBRARGRXRANR2E1
SCHEMBL8633015 0.81 RARA (0.48) RARARARBRARGRXRANR2E1
SCHEMBL8560773 0.81 RARA (0.48) RARARARBRARGRXRANR2E1
SCHEMBL7051352 0.81 RARA (0.48) RARARARBRARGRXRANR2E1
SCHEMBL8557715 0.78 RARA (0.48) RARARARBRARGRXRANR2E1
SCHEMBL6705630 0.78 RARA (0.48) RARARARBRARGRXRANR2E1
SCHEMBL8331911 0.77 RARB (0.63) RARARARBRARGRXRANR2E1

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
US-5808124-A BINDING TO RETINOID RECEPTORS ALLERGAN (US) 1998-09-15 US disclosed
US-5773594-A TREATING SKIN DISORDERS, REDUCING SIDE EFFECTS OF OTHER RETINOIDS ALLERGAN (US) 1998-06-30 US disclosed
US-5747542-A SKIN DISORDERS; ANTICANCER AGENTS ALLERGAN (US) 1998-05-05 US disclosed
US-5741896-A O- or S- substituted tetrahydronaphthalene derivatives having retinoid and/or retinoid antagonist-like biological activity ALLERGAN (US) 1998-04-21 US disclosed
US-5723666-A USEFUL AS REGULATORS OF CELL PROLIFERATION AND DIFFERENTIATION ALLERGAN (US) 1998-03-03 US disclosed