SCHEMBL30813506

SCHEMBL30813506

CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1ncnc2c1c(-c1ccc(N)c3nccn13)cn2-c1cccnc1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PI4KA P42356 1/20 0.34
▸ PI4K2B Q8TCG2 1/20 0.34
▸ PI4K2A Q9BTU6 1/20 0.34
▸ PI4KB Q9UBF8 1/20 0.34
▸ SRC P12931 6/20 0.32
▸ EGFR P00533 4/20 0.32
▸ KDR P35968 3/20 0.32
▸ NEK7 Q8TDX7 1/20 0.32
▸ GPR119 Q8TDV5 1/20 0.32
▸ CPB2 Q96IY4 1/20 0.31
▸ PIK3CD O00329 1/20 0.31
▸ ABL1 P00519 2/20 0.30
▸ ABL2 P42684 2/20 0.30
▸ CDK1 P06493 2/20 0.30

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
SCHEMBL27217697 0.96 SRC (0.33) PI4KAPI4K2BPI4K2API4KBSRC
SCHEMBL30813416 0.91 SRC (0.32) SRCEGFRKDR
SCHEMBL27217800 0.87 SRC (0.32) SRCEGFRKDRABL1ABL2
SCHEMBL27217699 0.83 RAB9A (0.32) PI4KAPI4K2BPI4K2API4KBSRC
SCHEMBL30813527 0.82 KDR (0.37) PI4KBSRCEGFRKDRPIK3CD
SCHEMBL30813586 0.81 RET (0.35) SRCNEK7
SCHEMBL30813564 0.81 SRC (0.41) SRCEGFRKDRABL1ABL2
SCHEMBL30813431 0.81 SRC (0.36) SRC
SCHEMBL30813443 0.80 FLT3 (0.38) —
SCHEMBL30813458 0.80 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240158394-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. 2024-05-16 — — US disclosed
WO-2024059200-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. (US) 2024-03-21 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240158394-A1 NEK7 INHIBITORS NEK7, NEK5, NEK1 PI4KA 658/4885PI4K2B 752/4885PI4K2A 822/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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