SCHEMBL24286382

SCHEMBL24286382

O=S(=O)(c1cccc(C(F)(F)F)c1)N1CCOc2ccc(-c3ccc(Cl)c(Cl)c3)cc21

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.55
▸ PKLR P30613 1/20 0.55
▸ RORC P51449 16/20 0.52
▸ KMT2A Q03164 1/20 0.46
▸ PAX8 Q06710 1/20 0.46
▸ CYP11B1 P15538 1/20 0.46
▸ CYP11B2 P19099 1/20 0.46

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
SCHEMBL24286223 0.92 PKM (0.53) PKMPKLRRORC
SCHEMBL24286545 0.91 RORC (0.62) PKMPKLRRORCCYP11B1CYP11B2
SCHEMBL24286390 0.91 PKM (0.57) PKMPKLRRORCKMT2APAX8
SCHEMBL24286566 0.90 RORC (0.57) PKMPKLRRORCKMT2APAX8
SCHEMBL24286476 0.90 PKM (0.55) PKMPKLRRORCKMT2APAX8
SCHEMBL24287078 0.90 RORC (0.56) PKMPKLRRORCCYP11B1CYP11B2
SCHEMBL24286198 0.90 RORC (0.63) PKMPKLRRORCCYP11B1CYP11B2
SCHEMBL24286832 0.89 PKM (0.50) PKMPKLRRORCKMT2APAX8
SCHEMBL24286707 0.89 RORC (0.55) PKMPKLRRORC
SCHEMBL24286486 0.88 RORC (0.64) PKMPKLRRORCKMT2APAX8

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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