SCHEMBL31560751

SCHEMBL31560751

O=C(O)C(F)(F)c1ccc(C(F)F)cn1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 12/20 0.37
SCN9A Q15858 1/20 0.34
SCN10A Q9Y5Y9 1/20 0.34
MRGPRX4 Q96LA9 2/20 0.33
TRPV4 Q9HBA0 1/20 0.32
GRIN2B Q13224 1/20 0.32

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
SCHEMBL17608798 1.00 P2RX7 (0.37) P2RX7SCN9ASCN10AMRGPRX4TRPV4
SCHEMBL31292214 0.81 DGAT1 (0.39) P2RX7SCN9AMRGPRX4
SCHEMBL17583206 0.79 POLB (0.37) P2RX7
SCHEMBL30628308 0.77 TRPV4 (0.35) P2RX7MRGPRX4TRPV4
SCHEMBL160471 0.77 TRPV4 (0.35) P2RX7MRGPRX4TRPV4
SCHEMBL30628280 0.75 RAB9A (0.42) TRPV4
SCHEMBL17420645 0.75 RAB9A (0.42) TRPV4
SCHEMBL17420409 0.75 L3MBTL1 (0.42)
SCHEMBL3394893 0.75 ALDH1A1 (0.48) TRPV4
SCHEMBL17420522 0.75 MRGPRX4 (0.40) MRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025074305-A1 N-(1-(AMINOMETHYL)CYCLOPROPYL)(ARYL OR HETEROARYL) CARBOXAMIDE DERIVATIVES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2025-04-10 WO disclosed