SCHEMBL9014848

SCHEMBL9014848

CCCCCCCCCOc1ccc(NC(=O)NC(N)=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FAAH O00519 14/20 0.61
CA12 O43570 1/20 0.60
CA1 P00915 1/20 0.60
CA2 P00918 1/20 0.60
CA9 Q16790 1/20 0.60
S1PR1 P21453 3/20 0.58
S1PR3 Q99500 3/20 0.58
GAA P10253 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56

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
SCHEMBL9014684 1.00 FAAH (0.61) FAAHCA12CA1CA2CA9
SCHEMBL9014657 0.97 FAAH (0.58) FAAHCA12CA1CA2CA9
SCHEMBL9014856 0.97 FAAH (0.58) FAAHCA12CA1CA2CA9
SCHEMBL7759451 0.88 ALDH1A1 (0.69) FAAHS1PR1S1PR3GAAL3MBTL1
SCHEMBL5530025 0.88 ALDH1A1 (0.69) FAAHS1PR1S1PR3GAAL3MBTL1
SCHEMBL23554170 0.88 ALDH1A1 (0.69) FAAHS1PR1S1PR3GAAL3MBTL1
SCHEMBL9503837 0.88 ALDH1A1 (0.69) FAAHS1PR1S1PR3GAAL3MBTL1
SCHEMBL27498683 0.86 GAA (0.64) FAAHCA12CA1CA2CA9
SCHEMBL11211595 0.84 ALDH1A1 (0.76) FAAHGAA
SCHEMBL6831704 0.84 ALDH1A1 (0.75) FAAHCA12CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5491256-A OIL SOLUBLE FUEL ADDITIVES WHICH DECOMPOSE TO FORM ISOCYANIC ACID(OIL INSOLUBLE) WHICH REDUCES NITROGEN OXIDES TO NITROGEN TEXACO INC. (US) 1996-02-13 US disclosed