SCHEMBL29613306

SCHEMBL29613306

Cc1cc(CN2CCN(C(=O)C3CCC3)[C@@H](C)C2)c(C)c(Nc2nnc([C@@H](C)O)o2)c1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RORC P51449 17/20 0.49
KCNH2 Q12809 3/20 0.48
DHODH Q02127 1/20 0.35

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
SCHEMBL21354256 1.00 RORC (0.49) RORCKCNH2DHODH
SCHEMBL19785799 1.00 RORC (0.49) RORCKCNH2DHODH
SCHEMBL19785924 1.00 RORC (0.49) RORCKCNH2DHODH
SCHEMBL29613294 1.00 RORC (0.49) RORCKCNH2DHODH
SCHEMBL21354311 0.98 RORC (0.51) RORCKCNH2DHODH
SCHEMBL21354308 0.98 RORC (0.51) RORCKCNH2DHODH
SCHEMBL29613310 0.98 RORC (0.51) RORCKCNH2DHODH
SCHEMBL21354310 0.98 RORC (0.47) RORCKCNH2
SCHEMBL19785809 0.98 RORC (0.47) RORCKCNH2
SCHEMBL29613379 0.98 RORC (0.47) RORCKCNH2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109476653-B Heteroaromatic modulators of retinoid-related orphan receptor gamma 利奥制药有限公司 2022-04-22 CN claimed
CN-109476653-B Heteroaromatic modulators of retinoid-related orphan receptor gamma 利奥制药有限公司 2022-04-22 CN disclosed