SCHEMBL16372250

SCHEMBL16372250

Cc1ncccc1C(=O)NC1CCC1c1ccc(Cl)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 7/20 0.43
▸ TAS1R3 Q7RTX0 4/20 0.41
▸ TAS1R1 Q7RTX1 4/20 0.41
▸ TAS1R2 Q8TE23 4/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ SLC6A9 P48067 3/20 0.40
▸ GRM5 P41594 1/20 0.39
▸ ACKR3 P25106 1/20 0.39
▸ GAA P10253 1/20 0.38
▸ DPP4 P27487 1/20 0.38
▸ CRHR1 P34998 1/20 0.38

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
SCHEMBL17799715 1.00 P2RX7 (0.43) P2RX7TAS1R3TAS1R1TAS1R2ALDH1A1
SCHEMBL19767310 0.85 TYK2 (0.41) P2RX7TAS1R3TAS1R1TAS1R2ALDH1A1
SCHEMBL16372435 0.85 ACKR3 (0.42) P2RX7ACKR3
SCHEMBL21273819 0.85 ACKR3 (0.42) P2RX7ACKR3
SCHEMBL29367888 0.85 ACKR3 (0.42) P2RX7ACKR3
SCHEMBL24543387 0.85 ACKR3 (0.42) P2RX7ACKR3
SCHEMBL19771728 0.85 ACKR3 (0.42) P2RX7ACKR3
SCHEMBL21273811 0.85 ACKR3 (0.42) P2RX7ACKR3
SCHEMBL30704818 0.85 ACKR3 (0.42) P2RX7ACKR3
SCHEMBL29687045 0.85 ACKR3 (0.42) P2RX7ACKR3

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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