SCHEMBL9643595

SCHEMBL9643595

CCCCC(=O)Oc1c(OC)c(OC)c(OCC)c2ccc(OC)cc12

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
TP53 P04637 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.41
ABCB11 O95342 1/20 0.39
MTNR1A P48039 3/20 0.39
MTNR1B P49286 2/20 0.39
DYRK1A Q13627 2/20 0.38
TDP1 Q9NUW8 1/20 0.37
KDM4E B2RXH2 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TSHR P16473 2/20 0.37
MAPK1 P28482 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
SCHEMBL9643375 1.00 MAPT (0.45) MAPTTP53L3MBTL1ABCB11MTNR1A
SCHEMBL9642136 0.94 TP53 (0.49) MAPTTP53ABCB11MTNR1AMTNR1B
SCHEMBL9642932 0.86 TP53 (0.46) MAPTTP53ABCB11MTNR1AMTNR1B
SCHEMBL9642492 0.86 TP53 (0.46) MAPTTP53ABCB11MTNR1AMTNR1B
SCHEMBL9642996 0.84 L3MBTL1 (0.44) MAPTL3MBTL1KDM4EHSD17B10TSHR
SCHEMBL9642722 0.83 MTNR1A (0.41) TP53ABCB11MTNR1AMTNR1BKDM4E
SCHEMBL9642101 0.81 L3MBTL1 (0.40) L3MBTL1KDM4EHSD17B10TSHR
SCHEMBL9642831 0.81 L3MBTL1 (0.40) L3MBTL1KDM4EHSD17B10TSHR
SCHEMBL9642971 0.80 L3MBTL1 (0.46) MAPTTP53L3MBTL1ABCB11MTNR1A
SCHEMBL9642163 0.80 L3MBTL1 (0.46) MAPTTP53L3MBTL1ABCB11MTNR1A

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 4 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