SCHEMBL8564703

SCHEMBL8564703

CC1(C)CCC(=O)c2ccc(C3OCCO3)cc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 4/20 0.34
RAB9A P51151 1/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
EPHX2 P34913 1/20 0.30
ABCC9 O60706 1/20 0.30
ABCC8 Q09428 1/20 0.30
KCNJ11 Q14654 1/20 0.30
KCNJ8 Q15842 1/20 0.30
KDM4E B2RXH2 2/20 0.30
ALDH1A1 P00352 2/20 0.30
MAPT P10636 2/20 0.30
RECQL P46063 2/20 0.30
TDP1 Q9NUW8 2/20 0.30
CES2 O00748 1/20 0.30
KDM1A O60341 1/20 0.30
POLB P06746 1/20 0.30
PTPRC P08575 1/20 0.30

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
SCHEMBL6449746 0.75 RXRA (0.42)
SCHEMBL6103201 0.74 RAB9A (0.35) RAB9AMEN1KMT2ANPSR1BUB1
SCHEMBL5648628 0.73 PGR (0.49) PGRMAOAMAOBMEN1KMT2A
SCHEMBL13613855 0.73 PGR (0.37) PGRMAOAMAOBMEN1KMT2A
SCHEMBL6236790 0.72 CYP26A1 (0.39) PGRMEN1KMT2AALDH1A1MAPT
SCHEMBL24055007 0.72 PGR (0.50) PGR
SCHEMBL1806400 0.72 PBRM1 (0.49) MAOAMAOBKDM4EALDH1A1MAPT
SCHEMBL15717088 0.72 MALT1 (0.41) PGRMAPTKDM1AACHECES1
SCHEMBL3893981 0.72 MALT1 (0.41) PGRTDP1KDM1APTPRCPTPN1
SCHEMBL1808044 0.72 PGR (0.36) PGRRAB9AKDM4EALDH1A1RECQL

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