SCHEMBL24286486

SCHEMBL24286486

CC(C)c1ccc(-c2ccc3c(c2)N(S(=O)(=O)c2cccc(C(F)(F)F)c2)CCO3)cc1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 16/20 0.64
▸ PKM P14618 1/20 0.51
▸ PKLR P30613 1/20 0.51
▸ KMT2A Q03164 1/20 0.45
▸ PAX8 Q06710 1/20 0.45
▸ CYP11B1 P15538 1/20 0.44
▸ CYP11B2 P19099 1/20 0.44
▸ NR1I2 O75469 1/20 0.43
▸ RORA P35398 1/20 0.43
▸ RORB Q92753 1/20 0.43
▸ NR1H3 Q13133 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
SCHEMBL24286234 0.93 RORC (0.56) RORCPKMPKLRKMT2APAX8
SCHEMBL24286545 0.89 RORC (0.62) RORCPKMPKLRCYP11B1CYP11B2
SCHEMBL24286727 0.89 PKM (0.53) RORCPKMPKLRKMT2APAX8
SCHEMBL24286390 0.89 PKM (0.57) RORCPKMPKLRKMT2APAX8
SCHEMBL24286461 0.89 PKM (0.51) RORCPKMPKLRKMT2APAX8
SCHEMBL24286382 0.88 PKM (0.55) RORCPKMPKLRKMT2APAX8
SCHEMBL24286219 0.86 RORC (0.56) RORCPKMPKLRKMT2APAX8
SCHEMBL24287078 0.86 RORC (0.56) RORCPKMPKLRCYP11B1CYP11B2
SCHEMBL24286198 0.86 RORC (0.63) RORCPKMPKLRCYP11B1CYP11B2
SCHEMBL24286793 0.86 PKM (0.53) RORCPKMPKLRKMT2APAX8

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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