SCHEMBL19575900

SCHEMBL19575900

CCc1ccccc1CC(=O)Nc1ccc(-n2cc(C)c(C)n2)c(S(N)(=O)=O)c1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ P2RX4 Q99571 18/20 0.46
▸ KCNJ6 P48051 2/20 0.46
▸ KCNJ5 P48544 2/20 0.46
▸ KCNJ3 P48549 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ THRB P10828 1/20 0.43

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
SCHEMBL29716965 0.91 P2RX4 (0.56) P2RX4KCNJ6KCNJ5KCNJ3ALDH1A1
SCHEMBL19552372 0.91 P2RX4 (0.56) P2RX4KCNJ6KCNJ5KCNJ3ALDH1A1
SCHEMBL19576956 0.83 P2RX4 (0.49) P2RX4KCNJ6KCNJ5KCNJ3
SCHEMBL22353219 0.83 P2RX4 (0.42) P2RX4
SCHEMBL20561849 0.82 P2RX4 (0.56) P2RX4KCNJ6KCNJ5KCNJ3ALDH1A1
SCHEMBL19576993 0.82 P2RX4 (0.49) P2RX4KCNJ6KCNJ5KCNJ3
SCHEMBL19576529 0.81 P2RX4 (0.47) P2RX4KCNJ6KCNJ5KCNJ3ALDH1A1
SCHEMBL19576998 0.80 P2RX4 (0.47) P2RX4KCNJ6KCNJ5KCNJ3
SCHEMBL19551474 0.79 P2RX4 (0.53) P2RX4KCNJ6KCNJ5KCNJ3ALDH1A1
SCHEMBL29716839 0.79 P2RX4 (0.53) P2RX4KCNJ6KCNJ5KCNJ3ALDH1A1

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-3458443-B1 AROMATIC SULFONAMIDE DERIVATIVES Bayer Pharma AG (DE) 2020-08-19 — — EP disclosed
WO-2017191000-A1 AROMATIC SULFONAMIDE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-11-09 — — WO disclosed
Send feedback