SCHEMBL24944792

SCHEMBL24944792

CNc1nc(Nc2ccc(CCN3CCOCC3)cc2)c(C(N)=O)nc1-c1cncc2c1ncn2C

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CAMK2D Q13557 1/20 0.40
▸ EML4 Q9HC35 4/20 0.39
▸ ALK Q9UM73 4/20 0.39
▸ CDK1 P06493 2/20 0.39
▸ KDR P35968 2/20 0.39
▸ FGFR1 P11362 1/20 0.39
▸ SYK P43405 3/20 0.38
▸ IGF1R P08069 2/20 0.37
▸ CSF1R P07333 1/20 0.37
▸ RET P07949 2/20 0.37
▸ ROS1 P08922 2/20 0.37
▸ FLT3 P36888 2/20 0.37
▸ CCNC P24863 1/20 0.36
▸ CDK8 P49336 1/20 0.36
▸ TNIK Q9UKE5 1/20 0.36
▸ AXL P30530 1/20 0.36
▸ ETV6 P41212 1/20 0.36
▸ PDGFRA P16234 1/20 0.36
▸ BTK Q06187 1/20 0.36

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
SCHEMBL30205550 1.00 CAMK2D (0.40) CAMK2DEML4ALKCDK1KDR
SCHEMBL24944183 0.93 SYK (0.44) EML4ALKSYKFLT3CCNC
SCHEMBL30205579 0.93 SYK (0.44) EML4ALKSYKFLT3CCNC
SCHEMBL30205471 0.92 IKBKE (0.38) EML4ALKCDK1KDRSYK
SCHEMBL24943812 0.92 IKBKE (0.38) EML4ALKCDK1KDRSYK
SCHEMBL29173422 0.92 TNIK (0.39) CAMK2DCDK1KDRFGFR1SYK
SCHEMBL24944757 0.90 TBK1 (0.42) EML4ALKCDK1KDRFGFR1
SCHEMBL24943791 0.88 EML4 (0.48) EML4ALKSYKRETROS1
SCHEMBL24943841 0.87 SYK (0.38) EML4ALKSYKRETROS1
SCHEMBL24944172 0.86 TBK1 (0.39) EML4ALKCDK1KDRSYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117693503-A Substituted pyrazine-2-carboxamides as HPK1 inhibitors for the treatment of cancer 阿斯利康(瑞典)有限公司 2024-03-12 — — CN claimed
CN-117693503-A Substituted pyrazine-2-carboxamides as HPK1 inhibitors for the treatment of cancer 阿斯利康(瑞典)有限公司 2024-03-12 — — CN disclosed
WO-2023001794-A1 SUBSTITUTED PYRAZINE-2-CARBOXAMIDES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2023-01-26 — — WO disclosed
Send feedback