SCHEMBL21621133

SCHEMBL21621133

O=C(COc1ccc(Cl)c(F)c1)NC12CC1(COC(=O)Nc1ccc(Br)cc1)C2

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 17/20 0.48
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42

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
SCHEMBL21621148 0.89 ATF4 (0.47) ATF4MEN1KMT2A
SCHEMBL21621077 0.88 NPC1 (0.48) ATF4
SCHEMBL23773305 0.87 ATF4 (0.55) ATF4MEN1KMT2A
SCHEMBL21621065 0.87 ATF4 (0.45) ATF4MEN1KMT2A
SCHEMBL21621068 0.84 HDAC4 (0.44) ATF4MEN1KMT2A
SCHEMBL23773086 0.80 ATF4 (0.56) ATF4
SCHEMBL23773390 0.79 ATF4 (0.58) ATF4
SCHEMBL23773253 0.78 ATF4 (0.56) ATF4MEN1KMT2A
SCHEMBL21621097 0.78 ATF4 (0.49) ATF4
SCHEMBL23773235 0.77 ATF4 (0.55) ATF4

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-2020012339-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-01-16 — — WO disclosed
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