SCHEMBL9713639

SCHEMBL9713639

CCCCC1=C(O)C(=O)c2ccc(C)cc2C1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.47
MAOB P27338 1/20 0.47
ELANE P08246 2/20 0.46
LCK P06239 1/20 0.43
RAB9A P51151 3/20 0.42
TP53 P04637 2/20 0.42
MAPK1 P28482 2/20 0.42
NPC1 O15118 2/20 0.42
POLB P06746 1/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALOX5 P09917 9/20 0.41
MPEG1 Q2M385 7/20 0.41
MAPT P10636 4/20 0.41
XIAP P98170 3/20 0.41
ALDH1A1 P00352 3/20 0.41
GPR84 Q9NQS5 2/20 0.41
MEN1 O00255 2/20 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
SCHEMBL21469361 0.84 MAOA (0.59) MAOAMAOBELANELCKRAB9A
SCHEMBL8993532 0.84 MAOA (0.53) MAOAMAOBELANELCKRAB9A
SCHEMBL9713816 0.79 ALOX5 (0.48) MAOAMAOBELANEALOX5MPEG1
SCHEMBL571621 0.79 MAOA (0.56) MAOAMAOBELANELCKTP53
SCHEMBL572120 0.79 MAOA (0.56) MAOAMAOBELANELCKTP53
SCHEMBL9713844 0.78 ELANE (0.46) MAOAMAOBELANERAB9ATP53
SCHEMBL9353826 0.78 MAOA (0.68) MAOAMAOBELANELCKPOLB
SCHEMBL9627893 0.77 MAOA (0.45) MAOAMAOBELANELCKTP53
SCHEMBL3273093 0.76 ALOX5 (0.55) RAB9ATP53MAPK1ALOX5MPEG1
SCHEMBL9857129 0.76 ALOX5 (0.55) RAB9ATP53MAPK1ALOX5MPEG1

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