SCHEMBL9713667

SCHEMBL9713667

CC(=O)Oc1cc(OC(C)=O)c2ccc(Cl)cc2c1OC(C)=O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 1/20 0.65
HTT P42858 2/20 0.50
TOP1 P11387 3/20 0.42
KMT2A Q03164 4/20 0.41
KDM4E B2RXH2 4/20 0.41
POLB P06746 3/20 0.41
MAPT P10636 3/20 0.41
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 3/20 0.41
LMNA P02545 3/20 0.41
HPGD P15428 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
TDP1 Q9NUW8 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
GAA P10253 2/20 0.39
APEX1 P27695 1/20 0.39
RECQL P46063 1/20 0.39
BLM P54132 1/20 0.39
MAPK1 P28482 2/20 0.38
TSHR P16473 2/20 0.38

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
SCHEMBL9627417 0.92 ABCB11 (0.68) ABCB11HTTKMT2AMAPTALDH1A1
SCHEMBL19027917 0.89 ABCB11 (0.56) ABCB11HTTTOP1KMT2AKDM4E
SCHEMBL10706901 0.88 HTT (0.68) ABCB11HTTTOP1KMT2AKDM4E
SCHEMBL9629306 0.86 ABCB11 (0.68) ABCB11HTTKMT2AKDM4EPOLB
SCHEMBL9713732 0.83 ABCB11 (0.56) ABCB11HTTKMT2AKDM4EPOLB
SCHEMBL9628176 0.83 ABCB11 (0.56) ABCB11HTTKMT2AKDM4EPOLB
SCHEMBL9628189 0.81 ABCB11 (0.70) ABCB11HTTKMT2AMAPTALDH1A1
SCHEMBL9713245 0.81 ABCB11 (0.53) ABCB11HTTKMT2AKDM4EPOLB
SCHEMBL9627379 0.80 ABCB11 (0.68) ABCB11HTTKMT2AKDM4EPOLB
SCHEMBL29371228 0.80 ABCB11 (0.73) ABCB11HTTTOP1KMT2AKDM4E

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