SCHEMBL7010945

SCHEMBL7010945

O=C(O)N1CCC2(CC1)N(CCCS(=O)(=O)c1ccc3cc(Cl)ccc3c1)C(=O)C[S+]2[O-]

nearest known ligand 0.41

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 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
SCHEMBL7020174 0.87 F10 (0.40) F10
SCHEMBL7016611 0.82 F10 (0.43) F10
SCHEMBL7012056 0.81 F10 (0.41) F10
SCHEMBL7016260 0.80 F10 (0.53) F10
SCHEMBL7017672 0.79 F10 (0.43) F10
SCHEMBL7018392 0.76 F10 (0.42) F10
SCHEMBL7018071 0.76 F10 (0.44) F10
SCHEMBL3905926 0.76 F10 (0.48) F10
SCHEMBL7013739 0.75 F10 (0.45) F10
SCHEMBL7019807 0.74 ALDH1A1 (0.44) F10

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
EP-1302462-A1 SULFONE DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2003-04-16 EP disclosed