SCHEMBL18301982

SCHEMBL18301982

COc1ccc(Oc2ccc(NC(=O)Cc3ccccc3Cl)cc2S(N)(=O)=O)cc1.COc1cccc(Oc2ccc(NC(=O)Cc3ccccc3Cl)cc2S(N)(=O)=O)c1.NS(=O)(=O)c1cc(NC(=O)Cc2ccccc2Cl)ccc1Oc1cccc(OC(F)F)c1

nearest known ligand 0.84

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ P2RX4 Q99571 19/20 0.84
▸ KCNJ5 P48544 1/20 0.58
▸ KCNJ3 P48549 1/20 0.58

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
SCHEMBL18301864 0.93 P2RX4 (0.80) P2RX4KCNJ5KCNJ3
SCHEMBL30591487 0.92 P2RX4 (1.00) P2RX4
SCHEMBL18301647 0.92 P2RX4 (1.00) P2RX4
SCHEMBL18301824 0.90 P2RX4 (0.86) P2RX4
SCHEMBL31290043 0.90 P2RX4 (0.86) P2RX4
SCHEMBL30591595 0.84 P2RX4 (1.00) P2RX4
SCHEMBL18301658 0.84 P2RX4 (1.00) P2RX4
SCHEMBL18301830 0.84 P2RX4 (0.78) P2RX4
SCHEMBL18301820 0.84 P2RX4 (0.79) P2RX4
SCHEMBL18301617 0.83 P2RX4 (0.83) P2RX4

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-3307715-A1 AROMATIC SULFONAMIDE DERIVATIVES Bayer Pharma Aktiengesellschaft (DE) 2018-04-18 — — EP claimed
WO-2016198374-A1 AROMATIC SULFONAMIDE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-12-15 — — WO claimed
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