SCHEMBL24286233

SCHEMBL24286233

O=S(=O)(c1cccc(C(F)(F)F)c1)N1CCOc2ccc(-c3cncc(C(F)(F)F)c3)cc21

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 1/20 0.53
▸ CYP11B2 P19099 1/20 0.53
▸ PKM P14618 1/20 0.51
▸ PKLR P30613 1/20 0.51
▸ RORC P51449 14/20 0.47
▸ NR1H3 Q13133 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ PAX8 Q06710 1/20 0.43
▸ GPR142 Q7Z601 1/20 0.43

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
SCHEMBL24286390 0.91 PKM (0.57) CYP11B1CYP11B2PKMPKLRRORC
SCHEMBL24286496 0.89 RORC (0.54) CYP11B1CYP11B2PKMPKLRRORC
SCHEMBL24286371 0.85 RORC (0.58) PKMPKLRRORC
SCHEMBL24286701 0.85 PKM (0.53) CYP11B1CYP11B2PKMPKLRRORC
SCHEMBL18312995 0.85 RORC (0.62) PKMPKLRRORC
SCHEMBL24286431 0.85 RORC (0.62) CYP11B1CYP11B2PKMPKLRRORC
SCHEMBL24286727 0.85 PKM (0.53) CYP11B1CYP11B2PKMPKLRRORC
SCHEMBL24286545 0.85 RORC (0.62) CYP11B1CYP11B2PKMPKLRRORC
SCHEMBL24286633 0.85 PKM (0.51) CYP11B1CYP11B2PKMPKLRRORC
SCHEMBL24286383 0.84 PKM (0.53) CYP11B1CYP11B2PKMPKLRRORC

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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