SCHEMBL9713775

SCHEMBL9713775

COc1cc(OC(C)=O)c2cc(OCCc3ccccc3)ccc2c1OC(C)=O

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.51
ACHE P22303 1/20 0.46
MTNR1A P48039 2/20 0.44
MTNR1B P49286 2/20 0.44
PTGS2 P35354 1/20 0.43
MEN1 O00255 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
FFAR1 O14842 2/20 0.42
HTT P42858 1/20 0.42
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
SLC16A3 O15427 1/20 0.41

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
SCHEMBL9641912 0.86 ABCB11 (0.51) ALOX5ACHEMTNR1AMTNR1BMEN1
SCHEMBL9643309 0.82 ABCB11 (0.44) ALOX5ACHEMTNR1AMTNR1BMEN1
SCHEMBL9628112 0.82 TUBB4A (0.45) ALOX5MEN1KMT2AHTT
SCHEMBL9642419 0.81 ALOX5 (0.46) ALOX5ACHEMTNR1AMTNR1BMEN1
SCHEMBL9642538 0.81 ALOX5 (0.46) ALOX5ACHEMTNR1AMTNR1BMEN1
SCHEMBL9627729 0.80 TUBB4A (0.54) ALOX5MEN1KMT2AHTT
SCHEMBL9627895 0.80 CFD (0.47) ALOX5PTGS2HTT
SCHEMBL9643230 0.80 ABCB11 (0.44) ALOX5ACHEMTNR1AMTNR1BMEN1
SCHEMBL9713770 0.77 HTT (0.44) ALOX5MEN1KMT2AFFAR1HTT
SCHEMBL9643346 0.77 SLC2A4 (0.43) ALOX5ACHEMTNR1AMTNR1BMEN1

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