SCHEMBL24286684

SCHEMBL24286684

O=S(=O)(c1cccc(C(F)(F)F)c1)N1CCOc2ccc(-c3cc(OC(F)F)ccc3F)cc21

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 19/20 0.55
▸ NR1I2 O75469 4/20 0.51
▸ RORA P35398 1/20 0.51
▸ RORB Q92753 1/20 0.51
▸ PKM P14618 1/20 0.45
▸ PKLR P30613 1/20 0.45

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
SCHEMBL24286242 0.89 RORC (0.66) RORCNR1I2RORARORBPKM
SCHEMBL24286481 0.89 RORC (0.57) RORCNR1I2PKMPKLR
SCHEMBL18312294 0.87 RORC (0.64) RORCNR1I2PKMPKLR
SCHEMBL24286571 0.86 RORC (0.47) RORCNR1I2RORARORB
SCHEMBL24286199 0.86 RORC (0.55) RORCNR1I2PKMPKLR
SCHEMBL30110809 0.86 RORC (0.74) RORCNR1I2RORARORB
SCHEMBL18312797 0.86 RORC (0.74) RORCNR1I2RORARORB
SCHEMBL24286497 0.86 RORC (0.51) RORCNR1I2RORARORBPKM
SCHEMBL24286607 0.85 RORC (0.55) RORCNR1I2PKMPKLR
SCHEMBL24286467 0.85 RORC (0.61) RORCNR1I2RORARORB

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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