SCHEMBL21541792

SCHEMBL21541792

C[C@@H]1CN(c2nnc3cnc4ccc(-c5ccc(OCCCN(C)C)cc5)nc4n23)C[C@H](C)N1C

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 9/20 0.40
▸ HRH3 Q9Y5N1 2/20 0.40
▸ PRKDC P78527 1/20 0.38
▸ ATR Q13535 2/20 0.36
▸ PARP1 P09874 1/20 0.35
▸ LSS P48449 1/20 0.34
▸ TLR7 Q9NYK1 2/20 0.34

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
SCHEMBL21541838 0.87 ATM (0.39) ATMHRH3PRKDCATRTLR7
SCHEMBL21541765 0.87 ATM (0.40) ATMHRH3PRKDCATR
SCHEMBL21541869 0.85 CTSS (0.44) ATMPRKDC
SCHEMBL20374560 0.84 ATM (0.50) ATMPRKDCATRLSSTLR7
SCHEMBL21541736 0.84 ATM (0.50) ATMPRKDCATRLSSTLR7
SCHEMBL21541831 0.79 SYK (0.37) ATMHRH3ATR
SCHEMBL29559139 0.79 SYK (0.37) ATMHRH3ATR
SCHEMBL21541784 0.78 ATM (0.44) ATMPRKDCATR
SCHEMBL21541854 0.77 PRKDC (0.62) ATMHRH3PRKDCATR
SCHEMBL30359507 0.77 PRKDC (0.62) ATMHRH3PRKDCATR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3567041-A9 SUBSTITUTED FUSED HETEROARYL COMPOUND SERVING AS A KINASE INHIBITOR, AND APPLICATIONS THEREOF Impact Therapeutics (Shanghai), Inc (CN) 2022-04-20 — — EP claimed
EP-3567041-A1 SUBSTITUTED FUSED HETEROARYL COMPOUND SERVING AS A KINASE INHIBITOR, AND APPLICATIONS THEREOF Impact Therapeutics, Inc (CN) 2019-11-13 — — EP claimed
EP-3567041-B1 SUBSTITUTED FUSED HETEROARYL COMPOUND SERVING AS A KINASE INHIBITOR, AND APPLICATIONS THEREOF IMPACT THERAPEUTICS SHANGHAI INC (CN) 2023-12-27 — — EP disclosed
EP-3567041-A9 SUBSTITUTED FUSED HETEROARYL COMPOUND SERVING AS A KINASE INHIBITOR, AND APPLICATIONS THEREOF Impact Therapeutics (Shanghai), Inc (CN) 2022-04-20 — — EP disclosed
US-10874670-B2 Substituted fused heteroaromatic compounds as kinase inhibitors and the use thereof IMPACT THERAPEUTICS, INC. (CN) 2020-12-29 — — US disclosed
EP-3567041-A1 SUBSTITUTED FUSED HETEROARYL COMPOUND SERVING AS A KINASE INHIBITOR, AND APPLICATIONS THEREOF Impact Therapeutics, Inc (CN) 2019-11-13 — — EP 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-10874670-B2 Substituted fused heteroaromatic compounds as kinase inhibitors and the use thereof CHEK1, CHEK2, CDK1 ATM 35/4885HRH3 997/4885PRKDC 61/4885

“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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