SCHEMBL8104725

SCHEMBL8104725

O=C(O)CCCCCCCCn1c(-c2ccccc2)nc(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.78

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FAAH O00519 10/20 0.61
PTGIR P43119 4/20 0.57
BCHE P06276 2/20 0.48
TBXAS1 P24557 2/20 0.48
FABP4 P15090 1/20 0.48
FABP5 Q01469 1/20 0.48

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
SCHEMBL8103885 1.00 FAAH (0.61) FAAHPTGIRBCHETBXAS1FABP4
SCHEMBL8113624 1.00 FAAH (0.61) FAAHPTGIRBCHETBXAS1FABP4
SCHEMBL8104252 1.00 FAAH (0.61) FAAHPTGIRBCHETBXAS1FABP4
SCHEMBL8113557 0.94 FAAH (0.56) FAAHPTGIRBCHETBXAS1
SCHEMBL8113769 0.94 FAAH (0.56) FAAHPTGIRBCHETBXAS1
Bromide SCHEMBL9269320 0.92 FAAH (0.54) FAAHPTGIRBCHETBXAS1
SCHEMBL9269324 0.90 FAAH (0.52) FAAHPTGIRBCHETBXAS1
SCHEMBL8112175 0.90 FAAH (0.55) FAAHPTGIRBCHE
SCHEMBL8112509 0.90 FAAH (0.55) FAAHPTGIRBCHE
SCHEMBL8113809 0.90 FAAH (0.59) FAAHPTGIRBCHE

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
EP-0626969-B1 CoA-IT AND PAF INHIBITORS SMITHKLINE BEECHAM CORP (US) 2000-05-24 EP claimed
US-5648373-A CoA-IT and PAF inhibitors SMITHKLINE BEECHAM CORPORATION (US) 1997-07-15 US claimed
EP-0626969-B1 CoA-IT AND PAF INHIBITORS SMITHKLINE BEECHAM CORP (US) 2000-05-24 EP disclosed
US-5663053-A COENZYME A TRANSACYLASE FOR SCREENING SMITHKLINE BEECHAM CORPORATION (US) 1997-09-02 US disclosed
US-5648373-A CoA-IT and PAF inhibitors SMITHKLINE BEECHAM CORPORATION (US) 1997-07-15 US disclosed
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