SCHEMBL9642136

SCHEMBL9642136

CCCCC(=O)Oc1c(OC)c(OC)c(OC(=O)CCCC)c2cc(OC)ccc12

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.49
MAPT P10636 1/20 0.49
ABCB11 O95342 1/20 0.43
MTNR1A P48039 4/20 0.42
MTNR1B P49286 2/20 0.42
KDM4E B2RXH2 1/20 0.41
HSD17B10 Q99714 1/20 0.41
EPHX2 P34913 2/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL9643375 0.94 MAPT (0.45) TP53MAPTABCB11MTNR1AMTNR1B
SCHEMBL9643595 0.94 MAPT (0.45) TP53MAPTABCB11MTNR1AMTNR1B
SCHEMBL9642932 0.92 TP53 (0.46) TP53MAPTABCB11MTNR1AMTNR1B
SCHEMBL9642492 0.92 TP53 (0.46) TP53MAPTABCB11MTNR1AMTNR1B
SCHEMBL9642971 0.86 L3MBTL1 (0.46) TP53MAPTABCB11MTNR1AMTNR1B
SCHEMBL9642163 0.86 L3MBTL1 (0.46) TP53MAPTABCB11MTNR1AMTNR1B
SCHEMBL9642621 0.85 ABCB11 (0.48) ABCB11MTNR1AMTNR1BKDM4EHSD17B10
SCHEMBL9714009 0.84 MAPT (0.46) TP53MAPTMTNR1AMTNR1BKDM4E
SCHEMBL9642722 0.83 MTNR1A (0.41) TP53ABCB11MTNR1AMTNR1BKDM4E
SCHEMBL9642233 0.80 ABCB11 (0.60) MAPTABCB11EPHX2

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 8 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
US-4792556-A LIPOXYGENASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1988-12-20 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
US-4593120-A Naphthalene-1,4-dicarboxylic acid group SYNTEX (U.S.A.) INC. (US) 1986-06-03 US disclosed
EP-0107512-B1 1,4-ACYLOXYNAPHTHALENE DERIVATIVES, TOPICAL COMPOSITIONS CONTAINING THEM, METHODS FOR THEIR PREPARATION, AND INTERMEDIATES THEREFOR SYNTEX (U.S.A.) INC. (US) 1986-02-26 EP disclosed
US-4466981-A Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1984-08-21 US disclosed
EP-0107512-A1 1,4-Acyloxynaphthalene derivatives, topical compositions containing them, methods for their preparation, and intermediates therefor SYNTEX (U.S.A.) INC. (US) 1984-05-02 EP disclosed