SCHEMBL9628359

SCHEMBL9628359

CCCCCCC1=C(OC(C)C)C(=O)c2ccccc2C1=O

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.50
ALOX5 P09917 17/20 0.44
MPEG1 Q2M385 4/20 0.44
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
NR1H2 P55055 1/20 0.41
NR1H3 Q13133 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
SCHEMBL11661829 1.00 PTPN1 (0.50) PTPN1ALOX5MPEG1ALDH1A1MAPT
SCHEMBL9627408 0.87 MAPT (0.42) PTPN1ALDH1A1MAPTTHRBTDP1
SCHEMBL9628375 0.84 ALOX5 (0.57) PTPN1ALOX5MPEG1ALDH1A1MAPT
SCHEMBL11660838 0.84 ALOX5 (0.57) PTPN1ALOX5MPEG1ALDH1A1MAPT
SCHEMBL10951203 0.84 ALOX5 (0.57) PTPN1ALOX5MPEG1ALDH1A1MAPT
SCHEMBL11658545 0.83 PTPN1 (0.51) PTPN1ALOX5MPEG1
SCHEMBL9628157 0.83 ALOX5 (0.55) PTPN1ALOX5MPEG1ALDH1A1MAPT
SCHEMBL9629370 0.82 PTPN1 (0.50) PTPN1ALOX5MPEG1ALDH1A1MAPT
SCHEMBL10339035 0.81 PTPN1 (0.49) PTPN1ALOX5MPEG1ALDH1A1MAPT
SCHEMBL9627522 0.80 MAPT (0.45) ALDH1A1MAPTTHRBTDP1

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-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
US-4758587-A Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-07-19 US disclosed