SCHEMBL21541860

SCHEMBL21541860

CN(C)C1CCN(c2ccc(-c3ccc4ncc5nnc(C6CCOCC6)n5c4n3)cc2C(F)(F)F)CC1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PRKDC P78527 17/20 0.47
▸ PIK3CB P42338 13/20 0.47
▸ ATR Q13535 13/20 0.45
▸ ATRIP Q8WXE1 13/20 0.45
▸ ATM Q13315 9/20 0.45
▸ MTOR P42345 3/20 0.42
▸ CSF1R P07333 1/20 0.37
▸ CDK4 P11802 1/20 0.37
▸ CDK6 Q00534 1/20 0.37
▸ NOTUM Q6P988 1/20 0.36
▸ PDE3B Q13370 1/20 0.35
▸ PDE3A Q14432 1/20 0.35

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
SCHEMBL21541837 0.91 PRKDC (0.47) PRKDCPIK3CBATRATRIPATM
SCHEMBL21541721 0.90 PRKDC (0.36) PRKDCPIK3CBATRATRIPATM
SCHEMBL30689457 0.90 PRKDC (0.36) PRKDCPIK3CBATRATRIPATM
SCHEMBL21541754 0.90 PRKDC (0.48) PRKDCPIK3CBATRATRIPATM
SCHEMBL21541738 0.88 PRKDC (0.61) PRKDCPIK3CBATRATRIPATM
SCHEMBL21541733 0.86 CDK4 (0.37) MTORCSF1RCDK4CDK6NOTUM
SCHEMBL21541912 0.86 PRKDC (0.47) PRKDCPIK3CBATRATRIPATM
SCHEMBL30689454 0.86 PRKDC (0.47) PRKDCPIK3CBATRATRIPATM
SCHEMBL21541806 0.84 PRKDC (0.45) PRKDCPIK3CBATRATRIPATM
SCHEMBL21541808 0.83 S1PR1 (0.37) MTORCSF1RCDK4CDK6NOTUM

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 61/4885PIK3CB 89/4885ATR 91/4885

“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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