SCHEMBL24286444

SCHEMBL24286444

COc1cccc(-c2cc3c(cc2Cl)OCCN3S(=O)(=O)c2cccc(C(F)(F)F)c2)c1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 12/20 0.52
▸ PKM P14618 2/20 0.46
▸ PKLR P30613 2/20 0.46
▸ NPC1 O15118 1/20 0.43
▸ NR1H3 Q13133 1/20 0.42
▸ LMNA P02545 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41

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
SCHEMBL24286273 0.88 RORC (0.51) RORCPKMPKLRNR1H3
SCHEMBL24286347 0.87 RORC (0.64) RORCPKMPKLRNPC1
SCHEMBL24286427 0.85 PKM (0.50) RORCPKMPKLRNR1H3
SCHEMBL24286923 0.83 RORC (0.53) RORCPKMPKLR
SCHEMBL24286917 0.83 PKM (0.46) RORCPKMPKLRNR1H3
SCHEMBL24287226 0.83 RORC (0.61) RORC
SCHEMBL24286755 0.81 RORC (0.59) RORCPKMPKLRNPC1
SCHEMBL24286278 0.81 RORC (0.51) RORCPKMPKLRNR1H3
SCHEMBL24286631 0.81 RORC (0.55) RORCPKMPKLRNPC1
SCHEMBL20957362 0.80 RORC (0.81) 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
Send feedback