SCHEMBL16371880

SCHEMBL16371880

Cc1nccnc1C(=O)NC1CCC1c1ccc(Cl)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 1/20 0.40
▸ P2RX7 Q99572 2/20 0.40
▸ CNR1 P21554 8/20 0.38
▸ CNR2 P34972 8/20 0.38
▸ DPP4 P27487 3/20 0.38
▸ TAS1R3 Q7RTX0 1/20 0.38
▸ TAS1R1 Q7RTX1 1/20 0.38
▸ TAS1R2 Q8TE23 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ SLC6A9 P48067 2/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 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
SCHEMBL17799647 1.00 GRM5 (0.40) GRM5P2RX7CNR1CNR2DPP4
SCHEMBL17799674 0.88 GRM5 (0.39) GRM5P2RX7CNR1CNR2DPP4
SCHEMBL17799639 0.87 GRM5 (0.55) GRM5P2RX7DPP4TAS1R3TAS1R1
SCHEMBL16372105 0.87 GRM5 (0.55) GRM5P2RX7DPP4TAS1R3TAS1R1
SCHEMBL17799739 0.86 P2RX7 (0.38) GRM5P2RX7CNR1CNR2DPP4
SCHEMBL16371852 0.85 P2RX7 (0.44) GRM5P2RX7DPP4ALDH1A1SMN1; SMN2
SCHEMBL17799684 0.85 P2RX7 (0.44) GRM5P2RX7DPP4ALDH1A1SMN1; SMN2
SCHEMBL19767309 0.85 DPP4 (0.38) GRM5P2RX7CNR1CNR2DPP4
SCHEMBL16372250 0.84 P2RX7 (0.43) GRM5P2RX7DPP4TAS1R3TAS1R1
SCHEMBL17799715 0.84 P2RX7 (0.43) GRM5P2RX7DPP4TAS1R3TAS1R1

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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