SCHEMBL5214094

SCHEMBL5214094

COC(=O)c1cnc(NC=O)s1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR2 O15552 2/20 0.49
▸ RAB9A P51151 5/20 0.39
▸ NPC1 O15118 4/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ MAPKAPK2 P49137 1/20 0.38
▸ SMN1; SMN2 Q16637 5/20 0.38
▸ MAPK13 O15264 1/20 0.38
▸ MAPK12 P53778 1/20 0.38
▸ MAPK11 Q15759 1/20 0.38
▸ MAPK14 Q16539 1/20 0.38
▸ PRNP P04156 1/20 0.37
▸ TMPRSS15 P98073 2/20 0.37
▸ HCAR2 Q8TDS4 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ PPARG P37231 1/20 0.37
▸ NCOA2 Q15596 1/20 0.37
▸ NCOA1 Q15788 1/20 0.37

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
SCHEMBL16995339 0.84 HCAR2 (0.48) FFAR2RAB9ANPC1CYP1A2CYP3A4
SCHEMBL23388184 0.79 FFAR2 (0.48) FFAR2RAB9ANPC1CYP1A2CYP3A4
SCHEMBL14887666 0.79 FFAR2 (0.46) FFAR2RAB9ANPC1CYP1A2CYP3A4
SCHEMBL9481438 0.78 MAPT (0.39) FFAR2RAB9ANPC1CYP1A2CYP3A4
SCHEMBL9481429 0.78 MAPT (0.39) FFAR2RAB9ANPC1CYP1A2CYP3A4
SCHEMBL2370795 0.78 FFAR2 (0.53) FFAR2RAB9AMAPKAPK2SMN1; SMN2
SCHEMBL5213265 0.77 FFAR2 (0.46) FFAR2RAB9ANPC1CYP1A2CYP3A4
SCHEMBL16742919 0.76 FFAR2 (0.45) FFAR2HCAR2LMNAPPARGNCOA2
SCHEMBL11165532 0.74 RAB9A (0.37) FFAR2RAB9ANPC1CYP1A2CYP3A4
SCHEMBL11165530 0.74 RAB9A (0.37) FFAR2RAB9ANPC1CYP1A2CYP3A4

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
EP-1322608-B1 DELTA1-PYRROLINES USED AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2007-05-02 — — EP claimed
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