SCHEMBL21541793

SCHEMBL21541793

CN(C)CCCOc1ccc(-c2ccc3ncn4cnc(N5CCOCC5)c4c3c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 10/20 0.48
▸ CYP3A4 P08684 4/20 0.43
▸ CYP2D6 P10635 3/20 0.43
▸ LMNA P02545 3/20 0.43
▸ MAPK1 P28482 3/20 0.43
▸ CLK4 Q9HAZ1 3/20 0.43
▸ TSHR P16473 2/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ ATR Q13535 4/20 0.43
▸ CYP1A2 P05177 3/20 0.43
▸ CYP2C19 P33261 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ HIF1A Q16665 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ USP2 O75604 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ PIK3CA P42336 7/20 0.42
▸ MTOR P42345 6/20 0.42
▸ PIK3CG P48736 2/20 0.42
▸ PIK3CD O00329 1/20 0.42

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
SCHEMBL21541745 0.88 ATM (0.55) ATMATRPIK3CAMTORPIK3CG
SCHEMBL30359524 0.88 ATM (0.55) ATMATRPIK3CAMTORPIK3CG
SCHEMBL21541844 0.82 ATM (0.51) ATMATRPIK3CAMTORPIK3CG
SCHEMBL21541811 0.71 ATM (0.61) ATMATRPIK3CAMTORPIK3CG
SCHEMBL30359531 0.71 ATM (0.61) ATMATRPIK3CAMTORPIK3CG
SCHEMBL21541735 0.70 ATM (0.58) ATMCYP3A4ATRMTORPIK3CB
SCHEMBL30012141 0.70 ATM (0.58) ATMATRPIK3CAMTORPIK3CG
SCHEMBL18824768 0.69 ATM (0.82) ATMATRPIK3CAMTORPIK3CG
SCHEMBL23294867 0.67 PARP1 (0.44) ATMTSHRHSD17B10PIK3CAPIK3CG
SCHEMBL21541748 0.66 ATM (0.56) ATMATRMTORPIK3CBPRKDC

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 7 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
CN-110167941-B Substituted fused heteroaryl compounds as kinase inhibitors and uses thereof 上海瑛派药业有限公司 2023-04-04 — — CN 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 35/4885CYP3A4 1252/4885CYP2D6 931/4885

“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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