SCHEMBL16371876

SCHEMBL16371876

O=C(NC1CCC1c1ccc(Cl)cc1Cl)c1ncncc1Cl

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 1/20 0.38
▸ DPP4 P27487 3/20 0.36
▸ TAS1R3 Q7RTX0 1/20 0.36
▸ TAS1R1 Q7RTX1 1/20 0.36
▸ TAS1R2 Q8TE23 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ CNR1 P21554 3/20 0.34
▸ CNR2 P34972 1/20 0.34
▸ SLC6A9 P48067 2/20 0.34

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
SCHEMBL16372315 0.85 AKT1 (0.39) —
SCHEMBL17799751 0.84 MC1R (0.39) KMT2A
SCHEMBL17799684 0.83 P2RX7 (0.44) P2RX7DPP4
SCHEMBL16371852 0.83 P2RX7 (0.44) P2RX7DPP4
SCHEMBL17799674 0.81 GRM5 (0.39) P2RX7DPP4TAS1R3TAS1R1TAS1R2
SCHEMBL16371880 0.80 GRM5 (0.40) P2RX7DPP4TAS1R3TAS1R1TAS1R2
SCHEMBL17799647 0.80 GRM5 (0.40) P2RX7DPP4TAS1R3TAS1R1TAS1R2
SCHEMBL17799739 0.80 P2RX7 (0.38) P2RX7DPP4TAS1R3TAS1R1TAS1R2
SCHEMBL17799683 0.79 GRM5 (0.50) P2RX7DPP4TAS1R3TAS1R1TAS1R2
SCHEMBL17799652 0.78 HCRTR1 (0.45) P2RX7DPP4

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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