SCHEMBL2389718

SCHEMBL2389718

Clc1ncnc2[nH]c3ccccc3c12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 4/20 0.57
ABL1 P00519 1/20 0.55
ABL2 P42684 1/20 0.55
AURKA O14965 1/20 0.51
ERBB2 P04626 3/20 0.48
PTK6 Q13882 3/20 0.47
PDE4A P27815 1/20 0.46
PDE4B Q07343 1/20 0.46
PDE4C Q08493 1/20 0.46
PDE4D Q08499 1/20 0.46
LIMK1 P53667 1/20 0.45
CA5A P35218 1/20 0.43
ALK Q9UM73 1/20 0.43
IMPDH2 P12268 1/20 0.43
IMPDH1 P20839 1/20 0.43
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
POLB P06746 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
SCHEMBL30672219 1.00 EGFR (0.57) EGFRABL1ABL2AURKAERBB2
Hydrochloric Acid SCHEMBL7218016 0.98 EGFR (0.55) EGFRABL1ABL2AURKAERBB2
SCHEMBL30159366 0.79 LIMK1 (0.59) EGFRABL1ABL2ERBB2LIMK1
SCHEMBL3473013 0.79 LIMK1 (0.59) EGFRABL1ABL2ERBB2LIMK1
SCHEMBL6881920 0.79 AURKA (0.56) EGFRABL1ABL2AURKAALK
SCHEMBL31219008 0.79 AURKA (0.56) EGFRABL1ABL2AURKAALK
SCHEMBL7497481 0.79 AURKA (0.45) AURKAPDE4APDE4BPDE4CPDE4D
SCHEMBL13209220 0.78 EGFR (0.57) EGFRABL1ABL2ERBB2LIMK1
SCHEMBL6884961 0.78 EGFR (0.57) EGFRABL1ABL2AURKAERBB2
SCHEMBL3115940 0.77 AURKA (0.48) AURKAMAPTCHEK1CHEK2

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025217212-A1 MAC1 INHIBITORS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2025-10-16 WO disclosed
WO-2024199444-A1 HETEROAROMATIC RING COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF 上海翊维康医药有限责任公司 2024-10-03 WO disclosed
WO-2023001133-A1 PRMT5 INHIBITOR 上海齐鲁制药研究中心有限公司 2023-01-26 WO disclosed
WO-2023001133-A1 PRMT5 INHIBITOR 上海齐鲁制药研究中心有限公司 2023-01-26 WO disclosed
US-8999988-B2 Protein kinase inhibitors ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2015-04-07 US disclosed
US-8618121-B2 9H-pyrimido[4,5-B]indoles, 9H-pyrido[4',3':4,5]pyrrolo[2,3-D]pyridines, and 9H 1,3,6,9 tetraaza-fluorenes as CHK1 kinase function inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2013-12-31 US disclosed
US-20130302303-A1 PROTEIN KINASE INHIBITORS ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA 2013-11-14 US disclosed
US-8552018-B2 Substituted tricyclic compounds as protein kinase inhibitors ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2013-10-08 US disclosed
US-20110212929-A1 Protein Kinase Inhibitors ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA 2011-09-01 US disclosed
WO-2011056739-A1 COMPOUNDS AND METHODS GLAXOSMITHKLINE LLC (US) 2011-05-12 WO disclosed
US-7326712-B2 Substituted tricyclic compounds as protein kinase inhibitors ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2008-02-05 US disclosed
US-7312226-B2 Substituted tricyclic compounds as protein kinase inhibitors ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2007-12-25 US disclosed
US-7205396-B2 Benzodeazaadenine derivative base and electronic material containing the same JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2007-04-17 US disclosed
US-7205396-B2 Benzodeazaadenine derivative base and electronic material containing the same JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2007-04-17 US disclosed
EP-1678166-A2 PROTEIN KINASE INHIBITORS Arizona Board of Regents on behalf of The University of Arizona (US) 2006-07-12 EP disclosed
US-20050277658-A1 Protein kinase inhibitors ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2005-12-15 US disclosed
US-20050239794-A1 Protein kinase inhibitors ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2005-10-27 US disclosed
US-20050239793-A1 Protein kinase inhibitors ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2005-10-27 US disclosed
US-20050227992-A1 Protein kinase inhibitors ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2005-10-13 US disclosed
WO-2005037825-A2 PROTEIN KINASE INHIBITORS ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2005-04-28 WO 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 (6 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-20050227992-A1 Protein kinase inhibitors CDK2, MAP3K1, MAP3K2 EGFR 957/4885ABL1 569/4885ABL2 441/4885
US-20050277658-A1 Protein kinase inhibitors CDK2, MAP3K1, MAP3K2 EGFR 957/4885ABL1 569/4885ABL2 441/4885
US-20050239794-A1 Protein kinase inhibitors CDK2, MAP3K1, MAP3K2 EGFR 957/4885ABL1 569/4885ABL2 441/4885
US-20050239793-A1 Protein kinase inhibitors CDK2, MAP3K1, MAP3K2 EGFR 957/4885ABL1 569/4885ABL2 441/4885
US-20130302303-A1 PROTEIN KINASE INHIBITORS CDK2, MAP3K1, MAP3K2 EGFR 957/4885ABL1 569/4885ABL2 441/4885
US-20110212929-A1 Protein Kinase Inhibitors CDK2, MAP3K1, MAP3K2 EGFR 957/4885ABL1 569/4885ABL2 441/4885

“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.