SCHEMBL9643144

SCHEMBL9643144

CCCCCOc1c(OCCCCC)c(OC(=O)CCC)c2c(Cl)cccc2c1OC(C)=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
CNR1 P21554 4/20 0.35
CNR2 P34972 4/20 0.35
EPHX2 P34913 2/20 0.34
CYP2C9 P11712 1/20 0.34
THRA P10827 2/20 0.34
THRB P10828 2/20 0.34
PLA2G2A P14555 1/20 0.34
MEN1 O00255 1/20 0.33
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HTT P42858 1/20 0.33
CCNB2 O95067 1/20 0.33
CCNE2 O96020 1/20 0.33

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
SCHEMBL9643118 1.00 PPARG (0.36) PPARGPPARACNR1CNR2EPHX2
SCHEMBL9643617 0.95 CNR1 (0.37) CNR1CNR2EPHX2CYP2C9THRA
SCHEMBL9642345 0.94 CNR1 (0.38) PPARGPPARACNR1CNR2CYP2C9
SCHEMBL9642018 0.92 THRB (0.35) CNR1CNR2EPHX2CYP2C9THRA
SCHEMBL9642599 0.92 THRB (0.35) CNR1CNR2EPHX2CYP2C9THRA
SCHEMBL9642619 0.92 THRB (0.38) CNR1CNR2CYP2C9THRATHRB
SCHEMBL9642842 0.92 THRB (0.38) CNR1CNR2CYP2C9THRATHRB
SCHEMBL9642526 0.91 POLM (0.40) PPARGPPARACNR1CNR2EPHX2
SCHEMBL9641640 0.87 KDM4E (0.35) PPARGPPARACNR1CNR2MEN1
SCHEMBL9643185 0.87 KDM4E (0.35) PPARGPPARACNR1CNR2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0215622-B1 NAPHTHALENE ANTI-PSORIATIC AGENTS AND PROCESS FOR MAKING THEM SYNTEX (U.S.A.) INC. (US) 1992-06-17 EP disclosed
US-4946845-A STABLE ANTIINFLAMMATORY AGENTS, LIPOXYGENASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1990-08-07 US disclosed
EP-0215622-A2 Naphthalene anti-psoriatic agents and process for making them SYNTEX (U.S.A.) INC. (US) 1987-03-25 EP disclosed