SCHEMBL27217841

SCHEMBL27217841

COCCn1cc(-c2ccc(N)c3nccn23)c2c(OC(=O)NC(=O)OC(C)(C)C)ncnc21

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 4/20 0.38
▸ RIPK1 Q13546 1/20 0.31
▸ PDPK1 O15530 1/20 0.31
▸ CCNB2 O95067 1/20 0.31
▸ PRKCB P05771 1/20 0.31
▸ CDK1 P06493 1/20 0.31
▸ LYN P07948 1/20 0.31
▸ CCNB1 P14635 1/20 0.31
▸ CCNA2 P20248 1/20 0.31
▸ CDK2 P24941 1/20 0.31
▸ GSK3B P49841 1/20 0.31
▸ RPS6KA3 P51812 1/20 0.31
▸ CCNA1 P78396 1/20 0.31
▸ CCNB3 Q8WWL7 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
SCHEMBL27217812 0.92 SRC (0.34) FLT3PDPK1CCNB2PRKCBCDK1
SCHEMBL27217843 0.89 RET (0.33) —
SCHEMBL27217684 0.84 KDR (0.35) FLT3
SCHEMBL27217802 0.83 EGFR (0.30) —
SCHEMBL27217890 0.83 RIPK2 (0.40) —
SCHEMBL30813443 0.83 FLT3 (0.38) FLT3RIPK1
SCHEMBL27217847 0.81 SRC (0.38) —
SCHEMBL27217699 0.81 RAB9A (0.32) —
SCHEMBL27217746 0.81 NEK7 (0.37) —
SCHEMBL27217840 0.81 FLT3 (0.37) FLT3RIPK1

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 FLT3 3178/4885RIPK1 46/4885PDPK1 730/4885

“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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