SCHEMBL24944455

SCHEMBL24944455

CNc1nc(Nc2ccc(N3C[C@@H]4C[C@H]3CN4C)cc2)c(C(N)=O)nc1-c1cncc2c1ncn2C

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FGFR4 P22455 1/20 0.35
▸ SYK P43405 2/20 0.34
▸ EML4 Q9HC35 9/20 0.34
▸ ALK Q9UM73 9/20 0.34
▸ RET P07949 7/20 0.34
▸ ROS1 P08922 7/20 0.34
▸ FLT3 P36888 7/20 0.34
▸ JAK1 P23458 2/20 0.34
▸ BTK Q06187 2/20 0.32
▸ LCK P06239 1/20 0.32
▸ JAK3 P52333 1/20 0.32
▸ WEE1 P30291 1/20 0.32

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
SCHEMBL24944779 1.00 FGFR4 (0.35) FGFR4SYKEML4ALKRET
SCHEMBL24944458 1.00 FGFR4 (0.35) FGFR4SYKEML4ALKRET
SCHEMBL30205785 1.00 FGFR4 (0.35) FGFR4SYKEML4ALKRET
Formic Acid SCHEMBL30205790 0.97 FGFR4 (0.33) FGFR4SYKEML4ALKRET
SCHEMBL30206070 0.92 FGFR4 (0.37) FGFR4JAK1JAK3WEE1
SCHEMBL30206261 0.92 FGFR4 (0.37) FGFR4JAK1JAK3WEE1
SCHEMBL24944958 0.88 ATM (0.36) SYKEML4ALKRETROS1
SCHEMBL24944962 0.88 ATM (0.36) SYKEML4ALKRETROS1
SCHEMBL24943820 0.88 ATM (0.36) SYKEML4ALKRETROS1
SCHEMBL30801947 0.87 JAK1 (0.33) 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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