SCHEMBL30180884

SCHEMBL30180884

Nc1ccc(-c2cn(C3CC3)c3ncnc(N)c23)nc1

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 7/20 0.63
▸ RET P07949 4/20 0.59
▸ RIPK2 O43353 8/20 0.58
▸ ABL1 P00519 6/20 0.57
▸ EGFR P00533 6/20 0.57
▸ ABL2 P42684 6/20 0.57

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
SCHEMBL23966729 1.00 SRC (0.63) SRCRETRIPK2ABL1EGFR
SCHEMBL20351628 0.83 SRC (0.80) SRCRIPK2ABL1EGFRABL2
SCHEMBL30180698 0.79 RET (0.58) SRCRETRIPK2ABL1EGFR
SCHEMBL23966914 0.79 RET (0.58) SRCRETRIPK2ABL1EGFR
SCHEMBL23966913 0.79 SRC (0.73) SRCRETRIPK2ABL1EGFR
SCHEMBL18044541 0.78 SRC (0.81) SRCRETRIPK2ABL1EGFR
SCHEMBL23966925 0.78 RIPK2 (0.72) SRCRETRIPK2ABL1EGFR
SCHEMBL28928811 0.78 EGFR (0.71) SRCRIPK2ABL1EGFRABL2
SCHEMBL28928810 0.78 EGFR (0.71) SRCRIPK2ABL1EGFRABL2
SCHEMBL23966720 0.77 SRC (0.70) SRCRETRIPK2ABL1EGFR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115843272-A Inhibitors of NEK7 kinase 哈利亚治疗公司 2023-03-24 — — CN disclosed
EP-4146348-A1 INHIBITORS OF NEK7 KINASE Halia Therapeutics, Inc. (US) 2023-03-15 — — EP disclosed
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