SCHEMBL30816102

SCHEMBL30816102

CC(C)(C)OC(=O)N1CCN2c3ccc(-c4cc(F)cc(OC(F)F)c4)cc3N(S(=O)(=O)c3cccc(C(F)(F)F)c3)C[C@@H]2C1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 20/20 0.62
▸ NR1I2 O75469 3/20 0.60
▸ RORA P35398 1/20 0.60
▸ RORB Q92753 1/20 0.60

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
SCHEMBL22278651 1.00 RORC (0.62) RORCNR1I2RORARORB
SCHEMBL23102394 1.00 RORC (0.62) RORCNR1I2RORARORB
SCHEMBL22278646 0.92 RORC (0.66) RORCNR1I2RORARORB
SCHEMBL29118058 0.92 RORC (0.66) RORCNR1I2RORARORB
SCHEMBL29170638 0.91 RORC (0.68) RORCNR1I2RORARORB
SCHEMBL29170642 0.91 RORC (0.68) RORCNR1I2RORARORB
SCHEMBL22278443 0.90 RORC (0.65) RORCNR1I2RORARORB
SCHEMBL22278656 0.90 RORC (0.61) RORCNR1I2RORARORB
SCHEMBL23102329 0.90 RORC (0.56) RORCNR1I2RORARORB
SCHEMBL23102321 0.90 RORC (0.56) RORCNR1I2RORARORB

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
CN-114096533-B Tri-ring compound, pharmaceutical composition containing same, preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2024-03-08 — — CN disclosed
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