SCHEMBL20002928

SCHEMBL20002928

C=CCN1CCC(Sc2ccc(F)cc2)(c2ccc(C(OCc3c(F)cccc3F)(C(F)(F)F)C(F)(F)F)cc2)C1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RORC P51449 20/20 0.67
NR1I2 O75469 1/20 0.48

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
SCHEMBL20002789 0.86 RORC (0.67) RORCNR1I2
SCHEMBL20003213 0.80 RORC (0.67) RORCNR1I2
SCHEMBL16886504 0.80 RORC (1.00) RORCNR1I2
SCHEMBL20002339 0.80 RORC (0.54) RORC
SCHEMBL20003023 0.78 RORC (0.64) RORCNR1I2
SCHEMBL20003184 0.77 RORC (0.72) RORCNR1I2
SCHEMBL20002919 0.77 RORC (0.56) RORC
SCHEMBL20002487 0.75 RORC (0.67) RORCNR1I2
SCHEMBL20002506 0.75 RORC (0.72) RORC
SCHEMBL20002565 0.75 RORC (0.72) 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-3092229-B1 PYRROLIDINYL SULFONE DERIVATIVES AND THEIR USE AS ROR GAMMA MODULATORS BRISTOL MYERS SQUIBB CO (US) 2018-03-28 EP disclosed