SCHEMBL28280338

SCHEMBL28280338

NCc1ccccc1CC(=O)Nc1ccc(-n2cc(C(F)(F)F)cn2)c(S(N)(=O)=O)c1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 18/20 0.46
F2 P00734 1/20 0.43
F10 P00742 1/20 0.43
KCNJ5 P48544 1/20 0.41
KCNJ3 P48549 1/20 0.41

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
SCHEMBL29718819 0.91 P2RX4 (0.54) P2RX4KCNJ5KCNJ3
SCHEMBL22894270 0.91 P2RX4 (0.46) P2RX4KCNJ5KCNJ3
SCHEMBL19551475 0.91 P2RX4 (0.54) P2RX4KCNJ5KCNJ3
SCHEMBL19552384 0.91 CA12 (0.50) P2RX4KCNJ5KCNJ3
SCHEMBL19551771 0.91 P2RX4 (0.50) P2RX4KCNJ5KCNJ3
SCHEMBL19551962 0.90 P2RX4 (0.49) P2RX4KCNJ5KCNJ3
SCHEMBL19551458 0.90 P2RX4 (0.57) P2RX4KCNJ5KCNJ3
SCHEMBL28870232 0.89 P2RX4 (0.47) P2RX4
SCHEMBL20929144 0.89 P2RX4 (0.44) P2RX4KCNJ5KCNJ3
SCHEMBL19551607 0.89 P2RX4 (0.51) P2RX4KCNJ5KCNJ3

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
CN-109415321-A aromatic sulfonamide derivatives 拜耳制药股份公司 2019-03-01 CN claimed
CN-109415321-A aromatic sulfonamide derivatives 拜耳制药股份公司 2019-03-01 CN disclosed