SCHEMBL9713704

SCHEMBL9713704

CCCCCCCC(=O)Oc1c(CCC)c(OCCC)c(OC(=O)CCCCCCC)c2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.41
ESR1 P03372 1/20 0.41
EPHX2 P34913 1/20 0.39
PPARG P37231 2/20 0.39
CES2 O00748 2/20 0.39
CES1 P23141 2/20 0.39
POLM Q9NP87 1/20 0.39
POLK Q9UBT6 1/20 0.39
POLL Q9UGP5 1/20 0.39
POLH Q9Y253 1/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
RECQL P46063 1/20 0.39
ALOX15 P16050 1/20 0.38
PLA2G2A P14555 1/20 0.38
PPARA Q07869 1/20 0.37
CNR2 P34972 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
THRA P10827 1/20 0.37

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
SCHEMBL17138128 0.83 EPHX2 (0.50) DGKAEPHX2CES2CES1POLM
SCHEMBL9629440 0.82 KDM4E (0.48) KMT2AKDM4EMEN1CNR2SMN1; SMN2
SCHEMBL20398671 0.81 EPHX2 (0.51) DGKAEPHX2CES2CES1POLM
SCHEMBL30003164 0.81 EPHX2 (0.51) DGKAEPHX2CES2CES1POLM
SCHEMBL29372133 0.81 EPHX2 (0.51) DGKAEPHX2CES2CES1POLM
SCHEMBL23271733 0.81 EPHX2 (0.51) DGKAEPHX2CES2CES1POLM
SCHEMBL20398624 0.81 EPHX2 (0.51) DGKAEPHX2CES2CES1POLM
SCHEMBL20398590 0.81 EPHX2 (0.51) DGKAEPHX2CES2CES1POLM
SCHEMBL29368355 0.81 EPHX2 (0.51) DGKAEPHX2CES2CES1POLM
SCHEMBL29360726 0.81 EPHX2 (0.51) DGKAEPHX2CES2CES1POLM

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
US-5091558-A Topical administeration SYNTEX (U.S.A.) INC. (US) 1992-02-25 US disclosed
EP-0150831-B1 NAPHTHALENE ANTI-PSORIATIC AGENTS SYNTEX (U.S.A.) INC. (US) 1988-08-10 EP disclosed
EP-0150831-A2 Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1985-08-07 EP disclosed