SCHEMBL517399

SCHEMBL517399

COc1cc(N2CCC(N3CCN(C)CC3)CC2)c(C)cc1N

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EGFR P00533 5/20 0.45
FGFR3 P22607 9/20 0.44
INSR P06213 1/20 0.44
IGF1R P08069 1/20 0.44
ALK Q9UM73 1/20 0.44
ACVR1 Q04771 2/20 0.40
KCNH2 Q12809 2/20 0.39
FGFR1 P11362 1/20 0.39
FGFR2 P21802 1/20 0.39
FGFR4 P22455 1/20 0.39
KDR P35968 1/20 0.39

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
SCHEMBL30018553 1.00 EGFR (0.45) EGFRFGFR3INSRIGF1RALK
SCHEMBL23154031 0.95 EGFR (0.41) EGFRFGFR3INSRIGF1RALK
SCHEMBL22520158 0.90 FGFR3 (0.42) EGFRFGFR3ACVR1KCNH2FGFR1
SCHEMBL10207156 0.90 PDCD1 (0.41)
SCHEMBL23759586 0.90 FGFR3 (0.45) EGFRFGFR3INSRIGF1RALK
SCHEMBL23759617 0.89 HTR1A (0.44)
SCHEMBL3122615 0.88 CCR4 (0.42)
SCHEMBL23154131 0.87 ALDH1A1 (0.45)
SCHEMBL25011531 0.86 GAA (0.42) EGFRFGFR3INSRIGF1RALK
SCHEMBL25011508 0.86 GAA (0.43) EGFRFGFR3ACVR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12297194-B2 N2-phenylpyrimidine-2,4-diamine compounds, and preparation methods and methods of use thereof Bridge Biotherapeutics, Inc. (KR) 2025-05-13 US disclosed
US-20250101052-A1 COMPOUND FOR EGFR KINASE INHIBITOR, COMPOSITION, AND USE THEREOF INNOVATION INSTITUTE FOR ARTIFICIAL INTELLIGENCE IN MEDICINE OF ZHEJIANG UNIVERSITY (CN) 2025-03-27 US disclosed
US-20240360102-A1 PYRIMIDINE-4,6-DIAMINE DERIVATIVE, A PREPARATION METHOD THEREFOR, AND A PHARMACEUTICAL APPLICATION THEREOF ABBISKO THERAPEUTICS CO., LTD. (CN) 2024-10-31 US disclosed
CN-118772111-A Substituted aminopyrimidine compound, pharmaceutical composition and application thereof 江南大学 2024-10-15 CN disclosed
EP-4393930-A1 CRYSTAL FORMS, PREPARATION METHOD AND APPLICATION OF ARYL PHOSPHINE OXIDE COMPOUND Chengdu Di'Ao Jiuhong Pharmaceutical Factory (CN) 2024-07-03 EP disclosed
EP-4382520-A1 PYRIMIDINE-4,6-DIAMINE DERIVATIVE, A PREPARATION METHOD THEREFOR, AND A PHARMACEUTICAL APPLICATION THEREOF Abbisko Therapeutics Co., Ltd. (CN) 2024-06-12 EP disclosed
US-20240051940-A1 SULFONAMIDES WITH EGFR INHIBITION ACTIVITIES AND THEIR USE THEREOF ACCUTAR BIOTECHNOLOGY INC. (US) 2024-02-15 US disclosed
EP-4313969-A1 N2-PHENYLPYRIMIDINE-2,4-DIAMINE COMPOUNDS, AND PREPARATION METHODS AND METHODS OF USE THEREOF Bridge Biotherapeutics, Inc. (KR) 2024-02-07 EP disclosed
CN-116981662-A Pyrimidine-4, 6-diamine derivative, preparation method and pharmaceutical application thereof 上海和誉生物医药科技有限公司 2023-10-31 CN disclosed
CN-112513029-B Nitrogen-containing aryl phosphorus oxide derivative, preparation method and application thereof 上海翰森生物医药科技有限公司 2023-10-24 CN disclosed
EP-3656769-A1 ARYL-PHOSPHORUS-OXYGEN COMPOUND AS EGFR KINASE INHIBITOR Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2020-05-27 EP disclosed
EP-2601186-A2 4-(1H-INDOL-3-YL)-PYRIMIDINES AS ALK INHIBITORS AstraZeneca AB (SE) 2013-06-12 EP disclosed
US-8461170-B2 Chemical compounds ASTRAZENECA AB (SE) 2013-06-11 US disclosed
US-8461170-B2 Chemical compounds ASTRAZENECA AB (SE) 2013-06-11 US disclosed
US-8461170-B2 Chemical compounds ASTRAZENECA AB (SE) 2013-06-11 US disclosed
WO-2012017239-A2 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2012-02-09 WO disclosed
WO-2012017239-A2 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2012-02-09 WO disclosed
US-20120028924-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2012-02-02 US disclosed
US-20120028924-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2012-02-02 US disclosed
US-20120028924-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2012-02-02 US 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 (5 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-20120028924-A1 CHEMICAL COMPOUNDS ALK, BRAF, ABL1 EGFR 40/4885FGFR3 87/4885INSR 860/4885
US-12297194-B2 N2-phenylpyrimidine-2,4-diamine compounds, and preparation methods and methods of use thereof EGFR, ERBB2, ERBB4 EGFR 1/4885FGFR3 48/4885INSR 1593/4885
US-20240051940-A1 SULFONAMIDES WITH EGFR INHIBITION ACTIVITIES AND THEIR USE THEREOF EGFR, ERBB2, ERBB4 EGFR 1/4885FGFR3 27/4885INSR 1065/4885
US-20250101052-A1 COMPOUND FOR EGFR KINASE INHIBITOR, COMPOSITION, AND USE THEREOF EGFR, ERBB2, ERBB3 EGFR 1/4885FGFR3 9/4885INSR 75/4885
US-20240360102-A1 PYRIMIDINE-4,6-DIAMINE DERIVATIVE, A PREPARATION METHOD THEREFOR, AND A PHARMACEUTICAL APPLICATION THEREOF WEE1, WEE2, EGFR EGFR 3/4885FGFR3 75/4885INSR 1027/4885

“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.