SCHEMBL21541806

SCHEMBL21541806

CN(C)C1CCN(c2ccc(-c3ccc4ncc5nnc(C6CCOCC6)n5c4n3)cn2)CC1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PRKDC P78527 16/20 0.45
▸ ATR Q13535 15/20 0.45
▸ ATRIP Q8WXE1 13/20 0.45
▸ PIK3CB P42338 13/20 0.45
▸ ATM Q13315 12/20 0.45
▸ MTOR P42345 4/20 0.45
▸ PIK3CA P42336 1/20 0.37

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
SCHEMBL21541912 0.91 PRKDC (0.47) PRKDCATRATRIPPIK3CBATM
SCHEMBL30689454 0.91 PRKDC (0.47) PRKDCATRATRIPPIK3CBATM
SCHEMBL21541754 0.86 PRKDC (0.48) PRKDCATRATRIPPIK3CBATM
SCHEMBL21541837 0.85 PRKDC (0.47) PRKDCATRATRIPPIK3CBATM
SCHEMBL21541834 0.85 PRKDC (0.61) PRKDCATRATRIPPIK3CBATM
SCHEMBL21541860 0.84 PRKDC (0.47) PRKDCATRATRIPPIK3CBATM
SCHEMBL21541847 0.80 PRKDC (0.43) PRKDCATRATRIPPIK3CBATM
SCHEMBL21541875 0.79 PRKDC (0.48) PRKDCATRATRIPPIK3CBATM
SCHEMBL21541734 0.78 PRKDC (0.47) PRKDCATRATRIPPIK3CBATM
SCHEMBL30359439 0.78 PRKDC (0.47) PRKDCATRATRIPPIK3CBATM

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 3 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 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 PRKDC 61/4885ATR 91/4885ATRIP 738/4885

“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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