SCHEMBL24286269

SCHEMBL24286269

COc1cc(-c2ccc3c(c2)N(S(=O)(=O)c2cccc(C(F)(F)F)c2)CCO3)nc(N(C)C)c1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 14/20 0.47
▸ PKM P14618 1/20 0.43
▸ PKLR P30613 1/20 0.43
▸ NPC1 O15118 1/20 0.42
▸ KCNQ1 P51787 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ PAX8 Q06710 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL24286487 0.91 PKM (0.46) RORCPKMPKLRKMT2APAX8
SCHEMBL24286520 0.90 PKM (0.46) RORCPKMPKLRKMT2APAX8
SCHEMBL24286274 0.88 PKM (0.47) RORCPKMPKLRKMT2APAX8
SCHEMBL24286559 0.86 PKM (0.45) RORCPKMPKLRKMT2APAX8
SCHEMBL24286232 0.85 RORC (0.51) RORCPKMPKLRNPC1KMT2A
SCHEMBL24286755 0.85 RORC (0.59) RORCPKMPKLRNPC1KMT2A
SCHEMBL24286219 0.84 RORC (0.56) RORCPKMPKLRNPC1KMT2A
SCHEMBL24286258 0.83 PKM (0.47) RORCPKMPKLRNPC1KMT2A
SCHEMBL24286347 0.83 RORC (0.64) RORCPKMPKLRNPC1KMT2A
SCHEMBL24287208 0.82 PKM (0.46) 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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