SCHEMBL8558259

SCHEMBL8558259

COCC1CCC(C)(C)c2ccc(C(=O)OOC(=O)c3ccccc3)cc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.38
LMNA P02545 1/20 0.38
CYP3A4 P08684 4/20 0.38
KDM4C Q9H3R0 1/20 0.37
RXRA P19793 10/20 0.36
CHRNA7 P36544 2/20 0.36
CHRNB2 P17787 1/20 0.36
CHRNA5 P30532 1/20 0.36
CHRNA4 P43681 1/20 0.36
RARB P10826 1/20 0.36
RARG P13631 1/20 0.36
CYP26A1 O43174 3/20 0.35
OPRM1 P35372 1/20 0.35
RXRB P28702 3/20 0.35
RXRG P48443 3/20 0.35
HTR3E A5X5Y0 1/20 0.35
HTR3B O95264 1/20 0.35
HTR3A P46098 1/20 0.35
HTR3D Q70Z44 1/20 0.35
HTR3C Q8WXA8 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
SCHEMBL8560364 0.93 CYP3A4 (0.38) LMNACYP3A4KDM4CRXRACHRNA7
SCHEMBL8641120 0.83 LMNA (0.44) F2LMNACYP3A4RXRACHRNA7
SCHEMBL8560366 0.83 KDM4C (0.39) LMNAKDM4CRXRARARBRARG
SCHEMBL6297298 0.83 RXRA (0.46) CYP3A4RXRARARBRARGCYP26A1
SCHEMBL6708918 0.80 RARA (0.57) LMNACYP3A4RARBRARGCYP26A1
SCHEMBL6596539 0.78 RARA (0.44) CYP3A4RARBRARGCYP26A1
SCHEMBL6293050 0.78 RARA (0.60) CYP3A4RXRARARBRARGCYP26A1
SCHEMBL8671861 0.77 RARB (0.58) CYP3A4RARBRARGCYP26A1CYP26B1
SCHEMBL6294126 0.77 RAB9A (0.48) LMNACYP3A4RARBRARGCYP26A1
SCHEMBL8642005 0.76 RXRA (0.40) LMNACYP3A4RXRACHRNA7RARB

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 6 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-5763635-A Tetrahydronaphthalene derivatives substituted in the 8 position with alkyhidene groups having retinoid and/or retinoid antagonist-like biological activity ALLERGAN (US) 1998-06-09 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