SCHEMBL30205605

SCHEMBL30205605

CC[S@](=N)(=O)c1ccc(Nc2nc(NC)c(-c3cncc4c3ncn4C)nc2C(N)=O)cc1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CDK1 P06493 10/20 0.34
▸ CDK2 P24941 10/20 0.34
▸ KDR P35968 9/20 0.34
▸ EML4 Q9HC35 6/20 0.34
▸ ALK Q9UM73 6/20 0.34
▸ CCNB1 P14635 2/20 0.34
▸ CCNE1 P24864 2/20 0.34
▸ RET P07949 1/20 0.33
▸ ROS1 P08922 1/20 0.33
▸ FLT3 P36888 1/20 0.33
▸ SYK P43405 1/20 0.33
▸ LCK P06239 2/20 0.32
▸ JAK3 P52333 2/20 0.32
▸ EGFR P00533 1/20 0.32
▸ BTK Q06187 1/20 0.32
▸ PDE5A O76074 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
SCHEMBL31195426 1.00 CDK1 (0.34) CDK1CDK2KDREML4ALK
SCHEMBL24945000 1.00 CDK1 (0.34) CDK1CDK2KDREML4ALK
SCHEMBL30206105 0.92 CDK1 (0.35) CDK1CDK2KDRCCNB1CCNE1
SCHEMBL31195397 0.92 CDK1 (0.35) CDK1CDK2KDRCCNB1CCNE1
SCHEMBL30205547 0.90 EML4 (0.31) EML4ALKSYKLCKJAK3
SCHEMBL30205576 0.90 EML4 (0.32) EML4ALKRETROS1FLT3
SCHEMBL29173296 0.86 EML4 (0.33) EML4ALKRETROS1FLT3
SCHEMBL24943828 0.85 CDK2 (0.37) CDK2SYKLCKJAK3BTK
SCHEMBL24944998 0.85 EML4 (0.35) EML4ALKRETROS1FLT3
SCHEMBL30206306 0.85 EML4 (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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4373817-B1 SUBSTITUTED PYRAZINE-2-CARBOXAMIDES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2025-05-21 — — EP claimed
EP-4373817-A1 SUBSTITUTED PYRAZINE-2-CARBOXAMIDES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER Astrazeneca AB (SE) 2024-05-29 — — EP claimed
WO-2023001794-A1 SUBSTITUTED PYRAZINE-2-CARBOXAMIDES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2023-01-26 — — WO claimed
EP-4373817-A1 SUBSTITUTED PYRAZINE-2-CARBOXAMIDES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER Astrazeneca AB (SE) 2024-05-29 — — EP disclosed
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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