SCHEMBL24286431

SCHEMBL24286431

O=S(=O)(c1cccc(C(F)(F)F)c1)N1CCOc2ccc(-c3cccc(F)c3)cc21

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 18/20 0.62
▸ PKM P14618 1/20 0.53
▸ PKLR P30613 1/20 0.53
▸ CYP11B1 P15538 1/20 0.48
▸ CYP11B2 P19099 1/20 0.48
▸ NR1I2 O75469 1/20 0.47
▸ RORA P35398 1/20 0.47
▸ RORB Q92753 1/20 0.47

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
SCHEMBL18312995 0.94 RORC (0.62) RORCPKMPKLRNR1I2RORA
SCHEMBL24286390 0.94 PKM (0.57) RORCPKMPKLRCYP11B1CYP11B2
SCHEMBL24286371 0.92 RORC (0.58) RORCPKMPKLRNR1I2RORA
SCHEMBL24286701 0.90 PKM (0.53) RORCPKMPKLRCYP11B1CYP11B2
SCHEMBL24286649 0.89 RORC (0.56) RORCPKMPKLRNR1I2RORA
SCHEMBL24286283 0.89 RORC (0.56) RORCPKMPKLRNR1I2RORA
SCHEMBL24286198 0.89 RORC (0.63) RORCPKMPKLRCYP11B1CYP11B2
SCHEMBL24286728 0.89 PKM (0.53) RORCPKMPKLRCYP11B1CYP11B2
SCHEMBL24286391 0.89 PKM (0.53) RORCPKMPKLRCYP11B1CYP11B2
SCHEMBL24286464 0.88 RORC (0.55) RORCPKMPKLRNR1I2

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-3307738-B1 ARYL DIHYDRO-2H-BENZO[B][1,4]OXAZINE SULFONAMIDE AND RELATED COMPOUNDS FOR USE AS AGONISTS OF RORY AND THE TREATMENT OF DISEASE UNIV MICHIGAN REGENTS (US) 2022-04-20 — — EP disclosed
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