SCHEMBL2020306

SCHEMBL2020306

CC(C)(O)c1ccnc(Cl)n1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HCRTR1 O43613 10/20 0.32
HCRTR2 O43614 10/20 0.32
GABRA1 P14867 1/20 0.32
GABRG2 P18507 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRA3 P34903 1/20 0.32
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
SYK P43405 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TRPV1 Q8NER1 1/20 0.31

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
SCHEMBL2018538 0.83 SYK (0.38) CYP19A1SMN1; SMN2GABRA1GABRG2GABRB3
SCHEMBL1661164 0.81 GABRA1 (0.39) CYP19A1GABRA1GABRG2GABRB3GABRA3
SCHEMBL31543495 0.81 GABRA1 (0.39) CYP19A1GABRA1GABRG2GABRB3GABRA3
SCHEMBL30632766 0.79 GABRA1 (0.38) CYP19A1GABRA1GABRG2GABRB3GABRA3
SCHEMBL26686630 0.79 GABRA1 (0.38) CYP19A1GABRA1GABRG2GABRB3GABRA3
SCHEMBL20015961 0.79 GABRA1 (0.32) CYP19A1GABRA1GABRG2GABRB3GABRA3
SCHEMBL31009000 0.79 NUDT1 (0.34) CYP19A1GABRA1GABRG2GABRB3GABRA3
SCHEMBL22576011 0.79 NUDT1 (0.34) CYP19A1GABRA1GABRG2GABRB3GABRA3
SCHEMBL2505184 0.78 SYK (0.35) CYP19A1CYP3A4TSHRCYP2C19SYK
SCHEMBL17059648 0.77 FFAR1 (0.35) SMN1; SMN2CYP3A4CYP2C19MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025233837-A1 4H-PYRIMIDO[1,2-A]PYRIMIDIN-4-ONE DERIVATIVES FOR USE AS NLRP3 INFLAMMASOME INHIBITORS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDER TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2025-11-13 WO disclosed
US-20250304577-A1 TYK2 INHIBITORS BIOGEN MA INC. 2025-10-02 US disclosed
CN-119654322-A TYK2 inhibitors 渤健马萨诸塞州股份有限公司 2025-03-18 CN disclosed
US-20240317725-A1 LPA1 SMALL MOLECULE ANTAGONIST TUOJIE BIOTECH (SHANGHAI) CO., LTD. (CN) 2024-09-26 US disclosed
EP-4375277-A1 LPA1 SMALL MOLECULE ANTAGONIST Tuojie Biotech (Shanghai) Co., Ltd. (CN) 2024-05-29 EP disclosed
CN-117460721-A LPA1 small molecule antagonist 上海拓界生物医药科技有限公司 2024-01-26 CN disclosed
US-20230339936-A1 COMPOUND HAVING KINASE INHIBITORY ACTIVITY CYTOSINLAB THERAPEUTICS CO., LTD. (CN) 2023-10-26 US disclosed
EP-4186901-A1 COMPOUND HAVING KINASE INHIBITORY ACTIVITY Cytosinlab Therapeutics Co., Ltd. (CN) 2023-05-31 EP disclosed
WO-2023001177-A1 LPA1 SMALL MOLECULE ANTAGONIST 上海拓界生物医药科技有限公司 2023-01-26 WO disclosed
WO-2023001177-A1 LPA1 SMALL MOLECULE ANTAGONIST 上海拓界生物医药科技有限公司 2023-01-26 WO disclosed
CN-102858767-A Aminopyrimidines as SYK inhibitors MERCK SHARP & DOHME 2013-01-02 CN disclosed
US-20120277192-A1 AMINOPYRIMIDINES AS SYK INHIBITORS MERCK SHARP & DOHME LLC 2012-11-01 US disclosed
EP-2515657-A1 TYROSINE KINASE INHIBITORS Merck Sharp & Dohme Corp. (US) 2012-10-31 EP disclosed
EP-2513098-A1 AMINOPYRIMIDINES AS SYK INHIBITORS Merck Sharp & Dohme Corp. (US) 2012-10-24 EP disclosed
US-20120264735-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2012-10-18 US disclosed
US-20120264735-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2012-10-18 US disclosed
US-20120264735-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2012-10-18 US disclosed
US-20110245205-A1 AMINOPYRIMIDINES AS SYK INHIBITORS MERCK SHARP & DOHME LLC 2011-10-06 US disclosed
WO-2011084402-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2011-07-14 WO disclosed
WO-2011075515-A1 AMINOPYRIMIDINES AS SYK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2011-06-23 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-20120264735-A1 TYROSINE KINASE INHIBITORS ABL1, MET, ERBB2 CYP19A1 3861/4885SMN1; SMN2 3605/4885L3MBTL1 1158/4885
US-20110245205-A1 AMINOPYRIMIDINES AS SYK INHIBITORS SYK, BTK, LCK CYP19A1 1405/4885SMN1; SMN2 4226/4885L3MBTL1 4452/4885
US-20250304577-A1 TYK2 INHIBITORS TYK2, JAK2, JAK1 CYP19A1 2585/4885SMN1; SMN2 1067/4885L3MBTL1 2886/4885
US-20230339936-A1 COMPOUND HAVING KINASE INHIBITORY ACTIVITY FLT3, ERBB2, ABL1 CYP19A1 1306/4885SMN1; SMN2 4360/4885L3MBTL1 2941/4885
US-20240317725-A1 LPA1 SMALL MOLECULE ANTAGONIST LPAR1, LPAR2, LPAR4 CYP19A1 1518/4885SMN1; SMN2 3596/4885L3MBTL1 3038/4885
US-20120277192-A1 AMINOPYRIMIDINES AS SYK INHIBITORS SYK, BTK, LCK CYP19A1 1405/4885SMN1; SMN2 4226/4885L3MBTL1 4452/4885

“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.