SCHEMBL21541741

SCHEMBL21541741

CC(C)N1[C@H](C)CN(c2nnc3cnc4ccc(-c5ccc(N6CCC(N(C)C)CC6)c(C(F)(F)F)c5)cc4n23)C[C@@H]1C

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ATR Q13535 12/20 0.38
▸ PRKDC P78527 12/20 0.38
▸ ATRIP Q8WXE1 10/20 0.38
▸ PIK3CB P42338 10/20 0.38
▸ ATM Q13315 9/20 0.38
▸ CSF1R P07333 1/20 0.37
▸ CDK4 P11802 1/20 0.37
▸ CDK6 Q00534 1/20 0.37
▸ MTOR P42345 5/20 0.37
▸ PIK3CA P42336 1/20 0.37
▸ SERPINA2 P20848 3/20 0.36
▸ HSD11B1 P28845 1/20 0.34
▸ SOS1 Q07889 2/20 0.33
▸ MELK Q14680 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
SCHEMBL27127196 1.00 ATR (0.38) ATRPRKDCATRIPPIK3CBATM
SCHEMBL21541791 0.93 ATR (0.39) ATRPRKDCATRIPPIK3CBATM
SCHEMBL27124103 0.93 ATR (0.39) ATRPRKDCATRIPPIK3CBATM
SCHEMBL27123583 0.89 PRKDC (0.37) ATRPRKDCATRIPPIK3CBATM
SCHEMBL21541796 0.89 PRKDC (0.37) ATRPRKDCATRIPPIK3CBATM
SCHEMBL21541859 0.89 PRKDC (0.39) ATRPRKDCATRIPPIK3CBATM
SCHEMBL21541730 0.88 PRKDC (0.40) ATRPRKDCATRIPPIK3CBATM
SCHEMBL21541746 0.88 CDK4 (0.37) ATRATMCSF1RCDK4CDK6
SCHEMBL21541732 0.87 PRKDC (0.40) ATRPRKDCATRIPPIK3CBATM
SCHEMBL21541724 0.84 PRKDC (0.40) ATRPRKDCATRIPPIK3CBATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3567041-B1 SUBSTITUTED FUSED HETEROARYL COMPOUND SERVING AS A KINASE INHIBITOR, AND APPLICATIONS THEREOF IMPACT THERAPEUTICS SHANGHAI INC (CN) 2023-12-27 — — 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 claimed
US-10874670-B2 Substituted fused heteroaromatic compounds as kinase inhibitors and the use thereof IMPACT THERAPEUTICS, INC. (CN) 2020-12-29 — — US 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 ATR 91/4885PRKDC 61/4885ATRIP 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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