SCHEMBL24286487

SCHEMBL24286487

CN(C)c1cc(C(F)(F)F)cc(-c2ccc3c(c2)N(S(=O)(=O)c2cccc(C(F)(F)F)c2)CCO3)n1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.46
▸ PKLR P30613 1/20 0.46
▸ RORC P51449 13/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ PAX8 Q06710 1/20 0.41
▸ CYP11B1 P15538 1/20 0.41
▸ CYP11B2 P19099 1/20 0.41
▸ KDM2B Q8NHM5 1/20 0.40
▸ NR1H3 Q13133 1/20 0.40

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
SCHEMBL24286520 0.94 PKM (0.46) PKMPKLRRORCL3MBTL1ALDH1A1
SCHEMBL24286274 0.92 PKM (0.47) PKMPKLRRORCL3MBTL1ALDH1A1
SCHEMBL24286269 0.91 RORC (0.47) PKMPKLRRORCL3MBTL1ALDH1A1
SCHEMBL24286559 0.90 PKM (0.45) PKMPKLRRORCL3MBTL1ALDH1A1
SCHEMBL24287208 0.85 PKM (0.46) PKMPKLRRORCL3MBTL1ALDH1A1
SCHEMBL24286584 0.85 PKM (0.45) PKMPKLRRORCL3MBTL1ALDH1A1
SCHEMBL24286581 0.85 PKM (0.45) PKMPKLRRORCL3MBTL1ALDH1A1
SCHEMBL24286236 0.85 PKM (0.52) PKMPKLRRORCL3MBTL1KMT2A
SCHEMBL24286260 0.84 PKM (0.49) PKMPKLRRORCL3MBTL1KMT2A
SCHEMBL24286654 0.84 PKM (0.51) 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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