SCHEMBL29175947

SCHEMBL29175947

CS(=O)(=O)N1CCC(n2cc(-c3ccc(N)c(F)c3)c3c(N)ncnc32)CC1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RIPK2 O43353 5/20 0.71
▸ SRC P12931 11/20 0.53
▸ ABL1 P00519 9/20 0.53
▸ EGFR P00533 9/20 0.53
▸ ABL2 P42684 9/20 0.53
▸ MEN1 O00255 2/20 0.52
▸ JAK2 O60674 1/20 0.52
▸ NTRK1 P04629 1/20 0.52
▸ INSR P06213 1/20 0.52
▸ LCK P06239 1/20 0.52
▸ NPM1 P06748 1/20 0.52
▸ CSF1R P07333 1/20 0.52
▸ LYN P07948 1/20 0.52
▸ RET P07949 1/20 0.52
▸ IGF1R P08069 1/20 0.52
▸ MET P08581 1/20 0.52
▸ ROS1 P08922 1/20 0.52
▸ PDGFRB P09619 1/20 0.52
▸ KIT P10721 1/20 0.52
▸ BCR P11274 1/20 0.52

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
SCHEMBL29998976 1.00 RIPK2 (0.71) RIPK2SRCABL1EGFRABL2
SCHEMBL29998998 0.91 RIPK2 (0.71) RIPK2SRCABL1EGFRABL2
SCHEMBL27088112 0.91 RIPK2 (0.71) RIPK2SRCABL1EGFRABL2
SCHEMBL23966784 0.87 RIPK2 (0.77) RIPK2SRCABL1EGFRABL2
SCHEMBL29998920 0.87 RIPK2 (0.77) RIPK2SRCABL1EGFRABL2
SCHEMBL2075045 0.87 RIPK2 (0.84) RIPK2SRCABL1EGFRABL2
SCHEMBL29999326 0.87 RIPK2 (0.84) RIPK2SRCABL1EGFRABL2
SCHEMBL23966761 0.87 RIPK2 (0.84) RIPK2SRCABL1EGFRABL2
SCHEMBL23966923 0.87 RIPK2 (0.91) RIPK2SRCABL1EGFRABL2
SCHEMBL29998925 0.87 RIPK2 (0.91) RIPK2SRCABL1EGFRABL2

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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