SCHEMBL9628563

SCHEMBL9628563

O=C1C(Cl)=CC(=O)c2c1cccc2-c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 4/20 0.49
AURKA O14965 1/20 0.49
AURKB Q96GD4 1/20 0.49
PTPRC P08575 2/20 0.42
PTPN1 P18031 2/20 0.42
CDC25B P30305 2/20 0.42
PTPRF P10586 1/20 0.42
CYP2A6 P11509 1/20 0.41
HDAC4 P56524 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
NR1H2 P55055 1/20 0.39
GAPDH P04406 1/20 0.39
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
RECQL P46063 2/20 0.38
IDO1 P14902 1/20 0.38
DNMT1 P26358 1/20 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
SCHEMBL9627478 0.79 AURKA (0.53) BACE1AURKAAURKBPTPRCCDC25B
SCHEMBL30003334 0.79 AURKA (0.53) BACE1AURKAAURKBPTPRCCDC25B
SCHEMBL27593809 0.76 AURKA (0.50) BACE1AURKAAURKBPTPRCCDC25B
SCHEMBL5084612 0.76 AURKA (0.74) BACE1AURKAAURKBCDC25BGAPDH
SCHEMBL30003366 0.76 AURKA (0.50) AURKAAURKBPTPRCCDC25BKDM4E
SCHEMBL23271871 0.76 AURKA (0.50) AURKAAURKBPTPRCCDC25BKDM4E
SCHEMBL30004050 0.76 AURKA (0.74) BACE1AURKAAURKBCDC25BGAPDH
SCHEMBL22187708 0.76 MEN1 (0.52) BACE1PTPRCPTPN1CDC25BPTPRF
SCHEMBL11424452 0.76 HDAC4 (0.52) BACE1PTPRCCDC25BHDAC4HDAC2
SCHEMBL9628201 0.75 HIF1A (0.55) BACE1PTPRCPTPN1CDC25BPTPRF

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 10 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-5091558-A Topical administeration SYNTEX (U.S.A.) INC. (US) 1992-02-25 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-0282056-A2 Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-09-14 EP disclosed
EP-0282006-A1 Naphtalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-09-14 EP disclosed
EP-0150831-B1 NAPHTHALENE ANTI-PSORIATIC AGENTS SYNTEX (U.S.A.) INC. (US) 1988-08-10 EP disclosed
US-4758587-A Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-07-19 US disclosed
EP-0150831-A2 Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1985-08-07 EP disclosed