SCHEMBL30813537

SCHEMBL30813537

COc1ccc(CNc2ncnc3c2c(-c2ccc(N)c4nccn24)cn3C2CCN(C(=O)OC(C)(C)C)CC2)c(OC)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 9/20 0.48
▸ EGFR P00533 7/20 0.47
▸ ABL1 P00519 6/20 0.47
▸ ABL2 P42684 6/20 0.47
▸ RIPK2 O43353 5/20 0.38
▸ EPHX2 P34913 1/20 0.38
▸ CTSD P07339 1/20 0.37
▸ CTSE P14091 1/20 0.37
▸ BACE1 P56817 1/20 0.37
▸ MAPT P10636 1/20 0.36
▸ STS P08842 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 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
SCHEMBL27217722 1.00 SRC (0.48) SRCEGFRABL1ABL2RIPK2
SCHEMBL27217743 0.92 SRC (0.41) SRCEGFRABL1ABL2RIPK2
SCHEMBL30813369 0.83 SRC (0.49) SRCEGFRABL1ABL2EPHX2
SCHEMBL27217619 0.83 SRC (0.49) SRCEGFRABL1ABL2EPHX2
SCHEMBL30813396 0.82 NEK7 (0.47) SRCEGFRABL1ABL2
SCHEMBL30813609 0.82 NEK7 (0.45) SRCEGFRABL1ABL2
SCHEMBL27217680 0.82 NEK7 (0.47) SRCEGFRABL1ABL2
SCHEMBL27217954 0.82 NEK7 (0.45) SRCEGFRABL1ABL2
SCHEMBL30813577 0.82 KDR (0.42) SRCABL1ABL2EPHX2
SCHEMBL27218020 0.82 KDR (0.42) SRCABL1ABL2EPHX2

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 SRC 1597/4885EGFR 4857/4885ABL1 3937/4885

“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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