SCHEMBL9714006

SCHEMBL9714006

O=C1C=C(Cl)C(=O)c2ccc(OCCc3ccccc3)cc21

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 15/20 0.58
MAOA P21397 14/20 0.58
TOP1 P11387 1/20 0.48
PPARG P37231 1/20 0.47
ACHE P22303 1/20 0.46
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL9713957 0.82 MAOB (0.55) MAOBMAOATOP1PPARGACHE
SCHEMBL9627540 0.77 MAPT (0.49) TOP1CA12CA1CA7CA9
SCHEMBL9642788 0.77 MAOB (0.66) MAOBMAOAPPARGACHECA12
SCHEMBL9713700 0.75 PDK2 (0.39) MAOBMAOATOP1PPARGNPC1
SCHEMBL9627609 0.75 PTPN1 (0.45) MAOBMAOAACHENPC1RAB9A
SCHEMBL3567336 0.74 PTPN1 (0.62) MAOBMAOATOP1PPARG
SCHEMBL9714001 0.73 IGLV6-57 (0.45)
SCHEMBL9628296 0.72 PTPN1 (0.49) CA1CA2CA7CA9
SCHEMBL30003312 0.72 PTPN1 (0.49) CA1CA2CA7CA9
SCHEMBL9628330 0.70 TOP1 (0.65) MAOBMAOATOP1PPARGACHE

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