SCHEMBL8566205

SCHEMBL8566205

CC(C)C1CCC(C)(C)c2cc(C(=O)C=COC(=O)c3ccccc3)ccc21

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
RARB P10826 4/20 0.32
RARA P10276 2/20 0.32
LMNA P02545 3/20 0.32
RAB9A P51151 2/20 0.32
HTT P42858 2/20 0.32
MAPT P10636 1/20 0.32
CYP26A1 O43174 1/20 0.32
RXRA P19793 6/20 0.32
RXRB P28702 5/20 0.32
RXRG P48443 3/20 0.32
HSP90AA1 P07900 1/20 0.32
MAOB P27338 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
TRPM8 Q7Z2W7 1/20 0.31
RARG P13631 3/20 0.31
CYP3A4 P08684 2/20 0.31
PDCD1 Q15116 1/20 0.31
CD274 Q9NZQ7 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
SCHEMBL8561400 0.81 CYP3A4 (0.33) NPC1RARBRARALMNARAB9A
SCHEMBL8563323 0.79 RARB (0.39) NPC1L3MBTL1RARBRARALMNA
SCHEMBL6292852 0.78 RARB (0.48) NPC1RARBRARALMNARAB9A
SCHEMBL6298153 0.75 RXRA (0.39) NPC1RARBRARALMNARAB9A
SCHEMBL8467836 0.69 RARB (0.50) RARBRARARXRARARG
SCHEMBL8554892 0.69 NPC1 (0.39) NPC1LMNARAB9AHTTMAPT
SCHEMBL8558861 0.69 RARA (0.36) NPC1L3MBTL1RARBRARALMNA
SCHEMBL8558089 0.69 RARA (0.37) RARBRARACYP26A1RXRARARG
SCHEMBL6294271 0.68 RXRA (0.49) RARBRARACYP26A1RXRARXRB
SCHEMBL6292438 0.66 RXRA (0.40) NPC1RARBRARARAB9AMAPT

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