SCHEMBL19767312

SCHEMBL19767312

O=C(N[C@H]1CC[C@H]1c1ccc(Cl)cc1Cl)c1nccnc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HCRTR1 O43613 9/20 0.41
▸ DPP4 P27487 2/20 0.39
▸ P2RX7 Q99572 3/20 0.39
▸ CNR2 P34972 1/20 0.35
▸ GRM5 P41594 1/20 0.35
▸ GRM4 Q14833 1/20 0.35
▸ TAS1R3 Q7RTX0 1/20 0.34
▸ TAS1R1 Q7RTX1 1/20 0.34
▸ TAS1R2 Q8TE23 1/20 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
SCHEMBL19767309 0.92 DPP4 (0.38) HCRTR1DPP4P2RX7CNR2GRM5
SCHEMBL17799674 0.86 GRM5 (0.39) HCRTR1DPP4P2RX7CNR2GRM5
SCHEMBL19767307 0.86 HCRTR1 (0.43) HCRTR1P2RX7GRM5
SCHEMBL30704818 0.85 ACKR3 (0.42) HCRTR1P2RX7CNR2
SCHEMBL21273819 0.85 ACKR3 (0.42) HCRTR1P2RX7CNR2
SCHEMBL24543387 0.85 ACKR3 (0.42) HCRTR1P2RX7CNR2
SCHEMBL19771728 0.85 ACKR3 (0.42) HCRTR1P2RX7CNR2
SCHEMBL21273811 0.85 ACKR3 (0.42) HCRTR1P2RX7CNR2
SCHEMBL29687045 0.85 ACKR3 (0.42) HCRTR1P2RX7CNR2
SCHEMBL16372435 0.85 ACKR3 (0.42) HCRTR1P2RX7CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3019476-B1 4-MEMBERED RING CARBOXAMIDES USED AS NEMATICIDES SYNGENTA PARTICIPATIONS AG (CH) 2018-01-17 — — EP disclosed
US-9867371-B2 4-membered ring carboxamides used as nematicides SYNGENTA PARTICIPATIONS AG (CH) 2018-01-16 — — US disclosed
US-9867371-B2 4-membered ring carboxamides used as nematicides SYNGENTA PARTICIPATIONS AG (CH) 2018-01-16 — — US disclosed
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