SCHEMBL4582422

SCHEMBL4582422

c1ccc(N(c2ccccc2)c2ncccn2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.54
ALDH1A1 P00352 2/20 0.54
TSHR P16473 2/20 0.44
MAPT P10636 4/20 0.44
KDM4E B2RXH2 3/20 0.44
CYP1A2 P05177 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
JAK2 O60674 1/20 0.41
RAB9A P51151 1/20 0.41
HDAC6 Q9UBN7 4/20 0.41
USP2 O75604 1/20 0.41
POLB P06746 1/20 0.39
CCR1 P32246 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
SCHEMBL16483989 0.91 ALDH1A1 (0.47) TDP1ALDH1A1TSHRMAPTKDM4E
SCHEMBL1121142 0.87 ALDH1A1 (0.44) TDP1ALDH1A1TSHRMAPTKDM4E
SCHEMBL4399532 0.82 ALDH1A1 (0.48) TDP1ALDH1A1TSHRMAPTKDM4E
SCHEMBL14208894 0.80 TDP1 (0.38) TDP1ALDH1A1TSHRMAPTKDM4E
SCHEMBL77495 0.80 ALDH1A1 (0.70) TDP1ALDH1A1TSHRMAPTKDM4E
SCHEMBL18294910 0.79 ALDH1A1 (0.45) TDP1ALDH1A1TSHRMAPTKDM4E
SCHEMBL28360398 0.79 MAPT (0.52) TDP1ALDH1A1TSHRMAPTKDM4E
SCHEMBL18542238 0.79 HDAC6 (0.46) TDP1ALDH1A1TSHRMAPTKDM4E
SCHEMBL4647647 0.77 ALDH1A1 (0.45) TDP1ALDH1A1TSHRMAPTKDM4E
SCHEMBL229388 0.77 ALDH1A1 (0.45) TDP1ALDH1A1TSHRMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115286583-B Diphenylamino pyrimidine-containing compound, preparation and application thereof as HDACs enzyme inhibitor 山东大学 2024-01-30 CN claimed
EP-3466943-B1 DIPHENYLAMINOPYRIMIDINE AND TRIAZINE COMPOUND, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF ARROMAX PHARMATECH CO LTD (CN) 2022-12-28 EP claimed
CN-115286583-A Diphenylaminopyrimidine-containing compound, preparation and application thereof as HDACs enzyme inhibitor 山东大学 2022-11-04 CN claimed
US-10647694-B2 Diphenylaminopyrimidine and triazine compound, and pharmaceutical composition and use thereof ARROMAX PHARMATECH CO., LTD. (CN) 2020-05-12 US claimed
US-20190256493-A1 DIPHENYLAMINOPYRIMIDINE AND TRIAZINE COMPOUND, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF ARROMAX PHARMATECH CO., LTD. (CN) 2019-08-22 US claimed
EP-3466943-A1 DIPHENYLAMINOPYRIMIDINE AND TRIAZINE COMPOUND, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF Arromax Pharmatech Co., Ltd. (CN) 2019-04-10 EP claimed
CN-106220608-B Diphenylamino pyrimidine and triaizine compounds, its Pharmaceutical composition and purposes 安润医药科技(苏州)有限公司 2018-11-27 CN claimed
CN-106220608-A Diphenylamino pyrimidine and triaizine compounds, its Pharmaceutical composition and purposes 张柏 2016-12-14 CN claimed
US-20260146084-A1 METHODS FOR TREATING MYELOFIBROSIS AND RELATED CONDITIONS DISC MEDICINE, INC. (US) 2026-05-28 US disclosed
CN-116157403-B Morphology of treasiril and method for producing same 海南先声再明医药股份有限公司 2025-04-25 CN disclosed
CN-119823124-A Compounds for targeted degradation of BRD9 C4医药公司 2025-04-15 CN disclosed
CN-113795249-B Pharmaceutical compounds for treating complement-mediated disorders 艾其林医药公司 2025-02-25 CN disclosed
CN-119325475-A Bicyclic substituted glutarimide cereblon binders C4医药公司 2025-01-17 CN disclosed
CN-115279370-B Compounds for targeted degradation of BRD9 C4医药公司 2025-01-10 CN disclosed
US-20150280139-A1 FLUORANTHENE DERIVATIVE, LIGHT-EMITTING DEVICE MATERIAL CONTAINING SAME, AND LIGHT-EMITTING DEVICE TORAY INDUSTRIES, INC. (JP) 2015-10-01 US disclosed
EP-2907803-A1 FLUORANTHENE DERIVATIVE, LUMINESCENT ELEMENT MATERIAL CONTAINING SAME, AND LUMINESCENT ELEMENT Toray Industries, Inc. (JP) 2015-08-19 EP disclosed
WO-2014057874-A1 FLUORANTHENE DERIVATIVE, LUMINESCENT ELEMENT MATERIAL CONTAINING SAME, AND LUMINESCENT ELEMENT 東レ株式会社 (JP) 2014-04-17 WO disclosed
US-20080176866-A1 3-(5-Bromo-2-{4-[5-bromo-4-((1R,2R)-2-hydroxy-1-methyl propylamino)-pyrimidin-2-ylamino]phenylamino}pyrimidin-4-ylamino)butan-2-ol; cell cycle and tyrosine kinase receptor inhibitor; antiproliferative, anticarcinogenic agent BAYER SCHERING PHARMA AG (DE) 2008-07-24 US disclosed
EP-1939185-A1 New types of hetaryl-phenylendiamin-pyrimidines as protein kinase inhibitors for the treatment of cancer Bayer Schering Pharma Aktiengesellschaft (DE) 2008-07-02 EP disclosed
WO-2008074515-A1 NOVEL HETARYL-PHENYLENE-DIAMINE PYRIMIDINE AS PROTEIN KINASE INHIBITORS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-06-26 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 (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-20190256493-A1 DIPHENYLAMINOPYRIMIDINE AND TRIAZINE COMPOUND, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF ALK, CD2, TYRO3 TDP1 1144/4885ALDH1A1 2069/4885TSHR 341/4885
US-20150280139-A1 FLUORANTHENE DERIVATIVE, LIGHT-EMITTING DEVICE MATERIAL CONTAINING SAME, AND LIGHT-EMITTING DEVICE FMNL1, AFF2, LEF1 TDP1 2458/4885ALDH1A1 1031/4885TSHR 4531/4885
US-20260146084-A1 METHODS FOR TREATING MYELOFIBROSIS AND RELATED CONDITIONS HAMP, BMP6, BMP1 TDP1 4774/4885ALDH1A1 4567/4885TSHR 503/4885
US-20080176866-A1 3-(5-Bromo-2-{4-[5-bromo-4-((1R,2R)-2-hydroxy-1-methyl propylamino)-pyrimidin-2-ylamino]phenylamino}pyrimidin-4-ylamino)butan-2-ol; cell cycle and tyrosine kinase receptor inhibitor; antiproliferative, anticarcinogenic agent CDK2, MKI67, ERBB2 TDP1 1971/4885ALDH1A1 523/4885TSHR 896/4885
US-10647694-B2 Diphenylaminopyrimidine and triazine compound, and pharmaceutical composition and use thereof ALK, CD2, TYRO3 TDP1 1144/4885ALDH1A1 2069/4885TSHR 341/4885

“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.