SCHEMBL21541838

SCHEMBL21541838

C[C@@H]1CN(c2nnc3cnc4ccc(-c5ccc(OCCCN(C)C)c(F)c5)nc4n23)C[C@H](C)N1C

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 15/20 0.39
▸ PRKDC P78527 1/20 0.39
▸ HRH3 Q9Y5N1 2/20 0.36
▸ GRIN2B Q13224 1/20 0.34
▸ ATR Q13535 1/20 0.34
▸ PIK3CA P42336 4/20 0.33
▸ MTOR P42345 3/20 0.33
▸ CTSS P25774 1/20 0.33
▸ TLR9 Q9NR96 1/20 0.33
▸ TLR8 Q9NR97 1/20 0.33
▸ TLR7 Q9NYK1 1/20 0.33

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
SCHEMBL21541765 0.91 ATM (0.40) ATMPRKDCHRH3GRIN2BATR
SCHEMBL21541869 0.90 CTSS (0.44) ATMPRKDCCTSS
SCHEMBL21541824 0.87 ATM (0.49) ATMPRKDCHRH3ATRPIK3CA
SCHEMBL27123627 0.87 ATM (0.49) ATMPRKDCHRH3ATRPIK3CA
SCHEMBL21541792 0.87 ATM (0.40) ATMPRKDCHRH3ATRTLR7
SCHEMBL21541731 0.82 CTSS (0.42) ATMPRKDCCTSS
SCHEMBL21541816 0.81 CTSS (0.42) ATMPRKDCCTSS
SCHEMBL21541783 0.79 PRKDC (0.61) ATMPRKDCATRPIK3CAMTOR
SCHEMBL21541749 0.79 CSF1R (0.37) ATMATRPIK3CAMTOR
SCHEMBL21541770 0.78 ATM (0.49) ATMPRKDCATRPIK3CAMTOR

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-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-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 35/4885PRKDC 61/4885HRH3 997/4885

“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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