SCHEMBL24286351

SCHEMBL24286351

O=S(=O)(c1cccc(C(F)(F)F)c1)N1CCOc2ccc(-c3cccc(OC(F)F)n3)cc21

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 18/20 0.49
▸ PKM P14618 1/20 0.46
▸ PKLR P30613 1/20 0.46
▸ NR1I2 O75469 3/20 0.45
▸ RORA P35398 1/20 0.45
▸ RORB Q92753 1/20 0.45
▸ CYP11B1 P15538 1/20 0.41
▸ CYP11B2 P19099 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
SCHEMBL24286258 0.90 PKM (0.47) RORCPKMPKLRCYP11B1CYP11B2
SCHEMBL24286236 0.88 PKM (0.52) RORCPKMPKLRCYP11B1CYP11B2
SCHEMBL24286729 0.87 PKM (0.48) RORCPKMPKLRCYP11B1CYP11B2
SCHEMBL24286389 0.86 PKM (0.50) RORCPKMPKLRCYP11B1CYP11B2
SCHEMBL24287340 0.85 PKM (0.46) RORCPKMPKLRCYP11B1CYP11B2
SCHEMBL24286519 0.85 PKM (0.49) RORCPKMPKLRCYP11B1CYP11B2
SCHEMBL24286425 0.85 PKM (0.49) RORCPKMPKLRCYP11B1CYP11B2
SCHEMBL24286242 0.84 RORC (0.66) RORCPKMPKLRNR1I2RORA
SCHEMBL24286274 0.83 PKM (0.47) RORCPKMPKLRCYP11B1CYP11B2
SCHEMBL24286390 0.81 PKM (0.57) RORCPKMPKLRCYP11B1CYP11B2

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
Send feedback