SCHEMBL9628126

SCHEMBL9628126

CCCC1=C(OCC)C(=O)c2ccccc2C1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 4/20 0.49
PTPRC P08575 2/20 0.49
MAPT P10636 8/20 0.44
KDM4E B2RXH2 7/20 0.44
ALDH1A1 P00352 7/20 0.44
LMNA P02545 6/20 0.44
HPGD P15428 6/20 0.44
TDP1 Q9NUW8 4/20 0.44
CYP1A2 P05177 2/20 0.44
POLB P06746 2/20 0.44
CYP2D6 P10635 2/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
BLM P54132 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HIF1A Q16665 2/20 0.44
CDC25A P30304 2/20 0.44
MAP2K7 O14733 1/20 0.44
GMNN O75496 1/20 0.44
TP53 P04637 1/20 0.44

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
SCHEMBL9627480 0.91 PTPN1 (0.44) CDC25BPTPRCMAPTKDM4EALDH1A1
SCHEMBL9627536 0.87 CDC25B (0.53) CDC25BPTPRCMAPTKDM4EALDH1A1
SCHEMBL11658545 0.87 PTPN1 (0.51) CDC25BPTPRCPTPN1
SCHEMBL9628124 0.84 MAPT (0.61) CDC25BMAPTKDM4EALDH1A1LMNA
SCHEMBL3420371 0.82 CDC25B (0.60) CDC25BPTPRCMAPTKDM4EALDH1A1
SCHEMBL14307223 0.82 CDC25B (0.50) CDC25BPTPRCMAPTKDM4EALDH1A1
SCHEMBL14307224 0.81 FGFR1 (0.49) CDC25BPTPRCMAPTKDM4EALDH1A1
SCHEMBL9627601 0.81 CDC25B (0.47) CDC25BPTPRCMAPTKDM4EALDH1A1
SCHEMBL9627408 0.81 MAPT (0.42) CDC25BPTPRCMAPTKDM4EALDH1A1
SCHEMBL9627133 0.80 PTPN1 (0.46) CDC25BPTPRCMAPTKDM4EALDH1A1

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