SCHEMBL21729634

SCHEMBL21729634

CS(=O)(=O)c1ccc2c(c1)CN[C@H]2C(=O)Nc1ccc(N(Cc2ccc(C(F)(F)F)cc2)C2CC2)cn1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RORC P51449 17/20 0.53
NPY5R Q15761 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
BRAF P15056 1/20 0.37
KDR P35968 1/20 0.37

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
SCHEMBL21729638 0.88 RORC (0.42) RORCNPY5RL3MBTL1
SCHEMBL21729689 0.87 RORC (0.58) RORC
SCHEMBL21729690 0.87 RORC (0.58) RORC
SCHEMBL21729713 0.82 RORC (0.50) RORC
SCHEMBL21729660 0.71 RORC (0.56) RORC
SCHEMBL21729719 0.71 RORC (0.55) RORC
SCHEMBL29758649 0.70 RORC (1.00) RORC
SCHEMBL18939880 0.70 RORC (1.00) RORC
SCHEMBL18961493 0.69 RORC (0.84) RORC
Hydrochloric Acid SCHEMBL18940116 0.69 RORC (0.98) 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
WO-2020035556-A1 NOVEL HETEROAROMATIC MODULATORS OF THE RETINOID-RELATED ORPHAN RECEPTOR GAMMA LEO PHARMA A/S (DK) 2020-02-20 WO disclosed