SCHEMBL24286280

SCHEMBL24286280

O=S(=O)(c1cccc(C(F)(F)F)c1)N1CCOc2c(F)cc(-c3cccc(C(F)(F)F)n3)cc21

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.43
▸ PKLR P30613 1/20 0.43
▸ HTR6 P50406 2/20 0.42
▸ CYP11B1 P15538 1/20 0.42
▸ CYP11B2 P19099 1/20 0.42
▸ RORC P51449 8/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ KDM2B Q8NHM5 2/20 0.39
▸ NR1H3 Q13133 1/20 0.39
▸ CDK4 P11802 1/20 0.39
▸ CDK6 Q00534 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ CPT2 P23786 1/20 0.38
▸ CPT1A P50416 1/20 0.38
▸ CPT1B Q92523 1/20 0.38

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
SCHEMBL24286694 0.86 RORC (0.52) PKMPKLRHTR6CYP11B1CYP11B2
SCHEMBL24286236 0.85 PKM (0.52) PKMPKLRCYP11B1CYP11B2RORC
SCHEMBL24286552 0.84 RORC (0.44) PKMPKLRHTR6CYP11B1CYP11B2
SCHEMBL24286226 0.83 RORC (0.51) PKMPKLRHTR6CYP11B1CYP11B2
SCHEMBL24286803 0.82 RORC (0.49) PKMPKLRHTR6RORCNR1H3
SCHEMBL24286648 0.81 RORC (0.52) PKMPKLRHTR6RORCHTT
SCHEMBL24286445 0.81 RORC (0.54) PKMPKLRHTR6CYP11B1CYP11B2
SCHEMBL24286434 0.81 RORC (0.55) PKMPKLRHTR6RORC
SCHEMBL24287126 0.80 RORC (0.41) PKMPKLRHTR6RORC
SCHEMBL20957350 0.78 RORC (0.64) RORC

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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