SCHEMBL29638460

SCHEMBL29638460

Cc1cc(Nc2cc3c(cn2)c(=O)[nH]n3-c2ccc(C#N)c(Cl)c2)nc(C)n1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 7/20 0.37
AR P10275 9/20 0.35
TYK2 P29597 2/20 0.35
CYP11B1 P15538 1/20 0.34
CHEK1 O14757 1/20 0.33

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
SCHEMBL24557293 1.00 CYP11B2 (0.37) CYP11B2ARTYK2CYP11B1CHEK1
SCHEMBL24557313 0.89 CYP11B1 (0.35) CYP11B2ARTYK2CYP11B1
SCHEMBL29638434 0.89 CYP11B1 (0.35) CYP11B2ARTYK2CYP11B1
SCHEMBL29638542 0.89 TYK2 (0.37) CYP11B2TYK2
SCHEMBL24557290 0.89 TYK2 (0.37) CYP11B2TYK2
SCHEMBL29638471 0.88 IDH1 (0.34) ARTYK2
SCHEMBL24557317 0.87 ABCG2 (0.41) AR
SCHEMBL29638479 0.87 ABCG2 (0.41) AR
SCHEMBL24557251 0.86 JAK2 (0.37) TYK2
SCHEMBL29638415 0.86 JAK2 (0.37) TYK2

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-2022136914-A1 TYK2 INHIBITORS AND USES THEREOF SUDO BIOSCIENCES LIMITED (GB) 2022-06-30 WO disclosed