SCHEMBL31347540

SCHEMBL31347540

COc1cnc(Nc2cc(C)n(C)n2)nc1-c1c[nH]c2c(NC(C)=O)cccc12

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 1/20 0.50
▸ PGR P06401 1/20 0.50
▸ NR3C2 P08235 1/20 0.50
▸ AR P10275 1/20 0.50
▸ JAK1 P23458 16/20 0.49
▸ JAK2 O60674 16/20 0.49
▸ JAK3 P52333 2/20 0.46
▸ KCNH2 Q12809 2/20 0.46

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
SCHEMBL31347584 0.91 JAK1 (0.53) JAK1JAK2KCNH2
SCHEMBL31347577 0.88 JAK1 (0.47) JAK1JAK2
SCHEMBL31347601 0.84 JAK1 (0.53) NR3C1PGRNR3C2ARJAK1
SCHEMBL31347578 0.84 JAK1 (0.45) JAK1JAK2
SCHEMBL30756867 0.82 JAK1 (0.54) JAK1JAK2KCNH2
SCHEMBL26987570 0.82 JAK1 (0.54) JAK1JAK2KCNH2
SCHEMBL31347560 0.82 JAK1 (0.51) JAK1JAK2KCNH2
SCHEMBL26993838 0.79 JAK1 (0.47) JAK1JAK2KCNH2
SCHEMBL30757116 0.78 JAK1 (0.63) JAK1JAK2KCNH2
SCHEMBL26987232 0.78 JAK1 (0.63) JAK1JAK2KCNH2

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
CN-119403798-A Novel compounds as GCN2 inhibitors, pharmaceutical compositions and uses thereof 东亚ST 株式会社 2025-02-07 — — CN disclosed
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