SCHEMBL24944723

SCHEMBL24944723

CNc1nc(Nc2ccc(N3CC4CC3O4)cc2)c(C(N)=O)nc1-c1cncc2c1ncn2C

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ EML4 Q9HC35 10/20 0.36
▸ ALK Q9UM73 10/20 0.36
▸ RET P07949 10/20 0.35
▸ ROS1 P08922 10/20 0.35
▸ FLT3 P36888 10/20 0.35
▸ SYK P43405 5/20 0.34
▸ LCK P06239 1/20 0.31
▸ BTK Q06187 1/20 0.31

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
SCHEMBL30205565 0.91 EML4 (0.40) EML4ALKRETROS1FLT3
SCHEMBL24943820 0.89 ATM (0.36) EML4ALKRETROS1FLT3
SCHEMBL24944958 0.89 ATM (0.36) EML4ALKRETROS1FLT3
SCHEMBL24944962 0.89 ATM (0.36) EML4ALKRETROS1FLT3
SCHEMBL30206167 0.87 EML4 (0.41) EML4ALKRETROS1FLT3
SCHEMBL24944779 0.87 FGFR4 (0.35) EML4ALKRETROS1FLT3
SCHEMBL30205785 0.87 FGFR4 (0.35) EML4ALKRETROS1FLT3
SCHEMBL24944458 0.87 FGFR4 (0.35) EML4ALKRETROS1FLT3
SCHEMBL24944455 0.87 FGFR4 (0.35) EML4ALKRETROS1FLT3
SCHEMBL24944410 0.85 RET (0.38) EML4ALKRETROS1FLT3

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-2023001794-A1 SUBSTITUTED PYRAZINE-2-CARBOXAMIDES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2023-01-26 — — WO disclosed
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