SCHEMBL16372277

SCHEMBL16372277

O=C(NC1CCC1c1ccc(Cl)cc1)c1ccccc1I

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 1/20 0.48
▸ FPR1 P21462 5/20 0.43
▸ FPR2 P25090 4/20 0.43
▸ FAAH O00519 1/20 0.43
▸ MGLL Q99685 1/20 0.43
▸ CNR1 P21554 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ DRD4 P21917 1/20 0.39
▸ EPHX2 P34913 1/20 0.39
▸ TAS1R3 Q7RTX0 1/20 0.39
▸ TAS1R1 Q7RTX1 1/20 0.39
▸ TAS1R2 Q8TE23 1/20 0.39
▸ GRIA4 P48058 1/20 0.38
▸ HCRTR2 O43614 1/20 0.38
▸ CNR2 P34972 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
SCHEMBL17799762 1.00 SIGMAR1 (0.48) SIGMAR1FPR1FPR2FAAHMGLL
SCHEMBL17799705 0.86 NPC1 (0.47) FPR1FPR2MEN1KMT2A
SCHEMBL17799635 0.84 L3MBTL1 (0.46) FPR1FPR2MGLLCNR1MEN1
SCHEMBL17799699 0.84 NPC1 (0.51) FPR1FPR2MEN1KMT2ATAS1R3
SCHEMBL17799637 0.84 GRM5 (0.47) FPR1FPR2MGLLMEN1KMT2A
SCHEMBL16371986 0.84 NPC1 (0.51) FPR1FPR2MEN1KMT2ATAS1R3
SCHEMBL16372272 0.84 GRM5 (0.47) FPR1FPR2MGLLMEN1KMT2A
SCHEMBL17799749 0.83 SIGMAR1 (0.45) SIGMAR1FAAHMGLLDRD4TAS1R3
SCHEMBL16372239 0.83 SIGMAR1 (0.45) SIGMAR1FAAHMGLLDRD4TAS1R3
SCHEMBL17799750 0.81 LMNA (0.54) MGLLMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3019476-A1 4-MEMBERED RING CARBOXAMIDES USED AS NEMATICIDES Syngenta Participations AG (CH) 2016-05-18 — — EP disclosed
WO-2015003951-A1 4-MEMBERED RING CARBOXAMIDES USED AS NEMATICIDES SYNGENTA PARTICIPATIONS AG (CH) 2015-01-15 — — WO disclosed
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