SCHEMBL9628207

SCHEMBL9628207

CC1=C(Cl)C(=O)c2cc(C)ccc2C1=O

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.73
MAOB P27338 1/20 0.73
ELANE P08246 1/20 0.59
ALKBH3 Q96Q83 2/20 0.47
NQO1 P15559 3/20 0.45
POR P16435 3/20 0.45
LCK P06239 1/20 0.45
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
MITF O75030 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
IDO1 P14902 1/20 0.41
DNMT1 P26358 1/20 0.41
DNMT3L Q9UJW3 1/20 0.41
DNMT3A Q9Y6K1 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 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
SCHEMBL9643596 0.90 MAOA (0.68) MAOAMAOBELANEALKBH3NQO1
SCHEMBL30002985 0.90 MAOA (0.68) MAOAMAOBELANEALKBH3NQO1
SCHEMBL30905230 0.85 MAOA (1.00) MAOAMAOBELANEALKBH3NQO1
SCHEMBL571353 0.85 MAOA (1.00) MAOAMAOBELANEALKBH3NQO1
SCHEMBL9627793 0.84 S100A4 (0.59) MAOAMAOBELANEMEN1NPC1
SCHEMBL7812020 0.81 TDP2 (0.60) MAOAMAOBELANEALKBH3NQO1
SCHEMBL7812173 0.81 TDP2 (0.60) MAOAMAOBELANEALKBH3NQO1
SCHEMBL30003080 0.81 TDP2 (0.60) MAOAMAOBELANEALKBH3NQO1
SCHEMBL8160523 0.81 S100A4 (0.55) MAOAMAOBELANELCKNPC1
SCHEMBL8161461 0.81 S100A4 (0.55) MAOAMAOBELANELCKNPC1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5155132-A Nonsteroidal antiinflammatory agents; treating psoriasis SYNTEX (U.S.A.) INC. (US) 1992-10-13 US disclosed
US-5134161-A Enzyme inhibitors for skin disorders, antiinflammatory agents SYNTEX (U.S.A.) INC. (US) 1992-07-28 US disclosed
US-5089657-A Topical antiinflammatory agents SYNTEX (U.S.A.) INC. (US) 1992-02-18 US disclosed
US-4786652-A TOPICAL ADMINISTRATION SYNTEX (U.S.A.) INC. (US) 1988-11-22 US disclosed
EP-0282006-A1 Naphtalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-09-14 EP disclosed
EP-0282056-A2 Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-09-14 EP disclosed
US-4758587-A Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-07-19 US disclosed