SCHEMBL29175934

SCHEMBL29175934

NC(=O)Oc1ccc(-c2cn(C3CC3)c3ncnc(N)c23)cc1F

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RIPK2 O43353 6/20 0.64
▸ NEK7 Q8TDX7 8/20 0.57
▸ SRC P12931 5/20 0.55
▸ RET P07949 2/20 0.54
▸ KIF5B P33176 2/20 0.54
▸ KDR P35968 2/20 0.54
▸ KCNH2 Q12809 1/20 0.54
▸ CCDC6 Q16204 1/20 0.54
▸ ABL1 P00519 4/20 0.54
▸ EGFR P00533 4/20 0.54
▸ ABL2 P42684 4/20 0.54
▸ JAK2 O60674 1/20 0.53
▸ NTRK1 P04629 1/20 0.53
▸ INSR P06213 1/20 0.53
▸ LCK P06239 1/20 0.53
▸ NPM1 P06748 1/20 0.53
▸ CSF1R P07333 1/20 0.53
▸ LYN P07948 1/20 0.53
▸ IGF1R P08069 1/20 0.53
▸ MET P08581 1/20 0.53

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
SCHEMBL29175943 0.90 RIPK2 (0.53) RIPK2NEK7SRCRETKIF5B
SCHEMBL23966923 0.82 RIPK2 (0.91) RIPK2NEK7SRCRETKIF5B
SCHEMBL29998925 0.82 RIPK2 (0.91) RIPK2NEK7SRCRETKIF5B
SCHEMBL23966783 0.79 RIPK2 (0.70) RIPK2SRCRETKIF5BKDR
SCHEMBL23966929 0.78 NEK7 (0.64) RIPK2NEK7SRCFLT3
SCHEMBL29484486 0.78 NEK7 (0.64) RIPK2NEK7SRCFLT3
SCHEMBL23966761 0.78 RIPK2 (0.84) RIPK2SRCRETKIF5BKDR
SCHEMBL2075045 0.78 RIPK2 (0.84) RIPK2SRCRETKIF5BKDR
SCHEMBL29999326 0.78 RIPK2 (0.84) RIPK2SRCRETKIF5BKDR
SCHEMBL24072623 0.78 RIPK2 (0.69) RIPK2NEK7SRCPDGFRBKIT

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-117597346-A NEK7 inhibitors 哈利亚治疗公司 2024-02-23 — — CN disclosed
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