SCHEMBL25048306

SCHEMBL25048306

CNC(=O)C1CCC(n2cc(C)c3c(N)ncnc32)C1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADCY5 O95622 3/20 0.53
▸ ADK P55263 1/20 0.45
▸ RIPK2 O43353 7/20 0.44
▸ ABL1 P00519 3/20 0.44
▸ EGFR P00533 2/20 0.44
▸ ABL2 P42684 2/20 0.44
▸ RET P07949 5/20 0.43
▸ LCK P06239 3/20 0.43
▸ SRC P12931 3/20 0.43
▸ KDR P35968 2/20 0.42
▸ DAPK3 O43293 1/20 0.42
▸ MAP4K4 O95819 1/20 0.42
▸ PAK4 O96013 1/20 0.42
▸ FYN P06241 1/20 0.42
▸ CSF1R P07333 1/20 0.42
▸ IGF1R P08069 1/20 0.42
▸ FGFR1 P11362 1/20 0.42
▸ PRKACA P17612 1/20 0.42
▸ FLT1 P17948 1/20 0.42
▸ LTK P29376 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
SCHEMBL25049120 0.87 ADK (0.45) ADCY5ADKRIPK2ABL1EGFR
SCHEMBL25048763 0.84 ADCY5 (0.45) ADCY5ADKRIPK2ABL1EGFR
SCHEMBL24072104 0.80 RIPK2 (0.61) ADKRIPK2ABL1EGFRABL2
SCHEMBL19264031 0.78 RIPK2 (0.48) ADKRIPK2ABL1EGFRRET
SCHEMBL19264162 0.75 SRC (0.61) ADKRIPK2ABL1EGFRABL2
SCHEMBL19563041 0.74 ADK (0.55) ADKRIPK2ABL1EGFRABL2
SCHEMBL25049178 0.73 IGF1R (0.45) ADCY5EGFRSRCIGF1R
SCHEMBL19264280 0.72 SRC (0.59) ADKRIPK2ABL1EGFRABL2
SCHEMBL23732588 0.72 SRC (0.59) ADKRIPK2ABL1EGFRABL2
SCHEMBL10261381 0.72 FGR (0.57) ADKRIPK2ABL1EGFRABL2

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-2023017152-A1 SPECIFIC SMALL MOLECULE INHIBITORS THAT BLOCK KMT9 METHYLTRANSFERASE ACTIVITY AND FUNCTION ALBERT-LUDWIGS-UNIVERSITÄT FREIBURG (DE) 2023-02-16 — — WO disclosed
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