SCHEMBL9627679

SCHEMBL9627679

CCCC1=C(OC)C(=O)c2ccc(Cl)cc2C1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 2/20 0.47
LMNA P02545 5/20 0.41
ALDH1A1 P00352 4/20 0.41
MAPT P10636 4/20 0.41
KDM4E B2RXH2 3/20 0.41
HPGD P15428 3/20 0.41
CDC25A P30304 2/20 0.41
CDC25B P30305 2/20 0.41
TP53 P04637 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MAP2K7 O14733 1/20 0.41
GMNN O75496 1/20 0.41
CYP1A2 P05177 1/20 0.41
POLB P06746 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
ALOX15 P16050 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
SCHEMBL9627492 1.00 S100A4 (0.47) S100A4LMNAALDH1A1MAPTKDM4E
SCHEMBL9627210 0.84 ELANE (0.50) LMNAALDH1A1MAPTKDM4EHPGD
SCHEMBL9628124 0.82 MAPT (0.61) LMNAALDH1A1MAPTKDM4EHPGD
SCHEMBL9627461 0.82 ALDH1A1 (0.41) LMNAALDH1A1MAPTKDM4EHPGD
SCHEMBL9313126 0.82 S100A4 (0.62) S100A4LMNAALDH1A1MAPTKDM4E
SCHEMBL9627527 0.81 S100A4 (0.50) S100A4LMNAALDH1A1MAPTTDP1
SCHEMBL9627459 0.81 S100A4 (0.50) S100A4LMNAALDH1A1MAPTTDP1
SCHEMBL9627948 0.78 CDC25A (0.63) S100A4LMNAALDH1A1MAPTKDM4E
SCHEMBL9713806 0.76 S100A4 (0.50) S100A4LMNAALDH1A1MAPTKDM4E
SCHEMBL9713816 0.75 ALOX5 (0.48) ALDH1A1MAPTTDP1ALOX5

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