SCHEMBL29029237

SCHEMBL29029237

O=C(Cc1ccccc1OC(F)(F)F)Nc1ccnc(NC(=O)Cc2cc(F)cc(F)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.46
GLS O94925 2/20 0.44
ANO1 Q5XXA6 7/20 0.43
RIOK2 Q9BVS4 1/20 0.43
NLRP3 Q96P20 1/20 0.41
RORC P51449 2/20 0.41
QPCT Q16769 1/20 0.40

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
SCHEMBL30368445 0.86 NTRK1 (0.51) NTRK1SMN1; SMN2ANO1RORC
SCHEMBL26186528 0.79 P2RX4 (0.50) NTRK1SMN1; SMN2ANO1
SCHEMBL30285604 0.79 P2RX4 (0.50) NTRK1SMN1; SMN2ANO1
SCHEMBL30382576 0.77 NAMPT (0.50) NTRK1SMN1; SMN2RORC
SCHEMBL30285530 0.76 P2RX4 (0.53) NTRK1SMN1; SMN2ANO1
SCHEMBL26186498 0.76 P2RX4 (0.53) NTRK1SMN1; SMN2ANO1
SCHEMBL2182471 0.72 WNT3A (0.62)
SCHEMBL30285680 0.72 P2RX4 (0.54) NTRK1SMN1; SMN2ANO1
SCHEMBL26186522 0.72 P2RX4 (0.54) NTRK1SMN1; SMN2ANO1
SCHEMBL30368259 0.70 ANO1 (0.66) NTRK1ANO1

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
CN-115989218-A Use of N-phenylacetamides having P2X4 receptor antagonistic activity for the treatment of certain eye diseases 拜耳公司 2023-04-18 CN disclosed