SCHEMBL9192995

SCHEMBL9192995

CCOC(=O)CCCCCCCc1nc(-c2ccccc2Cl)c(-c2ccccc2Cl)[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
CYP4F2 P78329 1/20 0.44
CYP4A11 Q02928 1/20 0.44
FAAH O00519 2/20 0.39
ALOX5 P09917 2/20 0.39
CDC7 O00311 1/20 0.39
DBF4 Q9UBU7 1/20 0.39
TBXAS1 P24557 1/20 0.39
ALDH1A1 P00352 2/20 0.39
HSD17B10 Q99714 2/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TOP2A P11388 1/20 0.37
TP53 P04637 1/20 0.36

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
SCHEMBL9201734 0.84 RXRA (0.46) MAPTTBXAS1KDM4ELMNAHDAC1
SCHEMBL8119778 0.80 FAAH (0.52) MAPTCYP4F2CYP4A11FAAHALOX5
SCHEMBL9192910 0.75 FAAH (0.43) MAPTCYP4F2CYP4A11FAAHALOX5
SCHEMBL9194754 0.74 FAAH (0.43) MAPTCYP4F2CYP4A11FAAHALOX5
SCHEMBL14578158 0.74 MAPT (0.81) MAPTALDH1A1HSD17B10KDM4ELMNA
SCHEMBL9201163 0.73 NOX1 (0.44) MAPTFAAHALDH1A1KDM4ECYP1A2
SCHEMBL5395748 0.72 MAPT (0.83) MAPTALDH1A1HSD17B10KDM4ELMNA
SCHEMBL8118282 0.70 FAAH (0.46) FAAH
SCHEMBL8113633 0.70 FAAH (0.58) FAAHCDC7DBF4CYP1A2CYP2C9
SCHEMBL13335178 0.69 CYP4F2 (0.50) MAPTCYP4F2CYP4A11FAAHALOX5

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0626969-A4 CoA-IT AND PAF INHIBITORS. SMITHKLINE BEECHAM CORP (US) 1995-04-19 EP disclosed
EP-0626969-A1 CoA-IT AND PAF INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1994-12-07 EP disclosed
WO-1993016674-A1 CoA-IT AND PAF INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1993-09-02 WO disclosed
EP-0550502-A1 SUBSTITUTED IMIDAZOLES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1993-07-14 EP disclosed
WO-1992004330-A1 SUBSTITUTED IMIDAZOLES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1992-03-19 WO disclosed