SCHEMBL1403684

SCHEMBL1403684

Nc1ccc2cncnc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 1.00
MEN1 O00255 1/20 0.50
F2 P00734 1/20 0.50
LMNA P02545 1/20 0.50
CHRM2 P08172 1/20 0.50
HTR1A P08908 1/20 0.50
ADRA2A P08913 1/20 0.50
ADORA3 P0DMS8 1/20 0.50
MAOA P21397 1/20 0.50
DRD1 P21728 1/20 0.50
ACHE P22303 1/20 0.50
PTGS1 P23219 1/20 0.50
SLC6A2 P23975 1/20 0.50
SLC6A4 P31645 1/20 0.50
OPRM1 P35372 1/20 0.50
DRD3 P35462 1/20 0.50
KDR P35968 1/20 0.50
HTT P42858 1/20 0.50
SLC6A3 Q01959 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL28086831 0.89 EGFR (0.80) EGFRMEN1F2LMNACHRM2
SCHEMBL28086824 0.85 EGFR (0.73) EGFRMEN1F2LMNACHRM2
SCHEMBL28084464 0.85 EGFR (0.73) EGFRMEN1KMT2ATDO2IMPDH2
SCHEMBL29504195 0.83 EGFR (1.00) EGFRMEN1F2LMNACHRM2
SCHEMBL921632 0.83 EGFR (1.00) EGFRMEN1F2LMNACHRM2
SCHEMBL28210778 0.81 EGFR (0.67) EGFRTDO2IMPDH2MAPTPRKCZ
SCHEMBL8641138 0.78 EGFR (0.64) EGFRTDO2IMPDH2KDM4E
SCHEMBL24150219 0.78 EGFR (0.63) EGFRTDO2IMPDH2KDM4EPRKCZ
SCHEMBL24569425 0.76 EGFR (0.59) EGFRACHEIMPDH2KDM4E
SCHEMBL277540 0.75 EGFR (0.60) EGFRTDO2IMPDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116770379-A High corrosion resistant coating, preparation method, electrolyte and application thereof 聂正圆 2023-09-19 CN claimed
CN-101402611-A Compound with anti-leukocythemia liveness and method of preparing the same UNIV GUANGDONG PHARM (CN) 2009-04-08 CN claimed
WO-2024140595-A1 TRICYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF AND USE THEREOF 珂阑(上海)医药科技有限公司 2024-07-04 WO disclosed
CN-118255685-A Tricyclic compound, pharmaceutical composition and application thereof 珂阑(上海)医药科技有限公司 2024-06-28 CN disclosed
CN-112538072-B Aminopyrimidine EGFR inhibitors 齐鲁制药有限公司 2024-02-06 CN disclosed
US-11802120-B2 Fused cyclic urea derivatives as CRHR2 antagonist RAQUALIA PHARMA INC. (JP) 2023-10-31 US disclosed
CN-111868037-B Fused cyclic urea derivatives as CRHR2 antagonists 拉夸里亚创药株式会社 2023-10-13 CN disclosed
CN-116770379-A High corrosion resistant coating, preparation method, electrolyte and application thereof 聂正圆 2023-09-19 CN disclosed
US-20230165885-A1 TREATMENT OF EYE DISORDERS WITH URIDINE PHOSPHATE DERIVATIVES GLIAGUARD, INC. 2023-06-01 US disclosed
CN-115894486-A Hydrogenated pyridoquinazoline compound, composition and application thereof 北京赛特明强医药科技有限公司 2023-04-04 CN disclosed
EP-3774739-B1 FUSED CYCLIC UREA DERIVATIVES AS CRHR2 ANTAGONIST RAQUALIA PHARMA INC (JP) 2022-05-11 EP disclosed
US-20060116368-A1 4-Piperidinecarboxamide modulators of vanilloid VR1 receptor JANSSEN PHARMACEUTICA N.V. (BE) 2006-06-01 US disclosed
WO-2006058338-A2 4 - PIPERIDINECARBOXAMIDE DERIVATIVES AS MODULATORS OF VANILLOID VR1 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2006-06-01 WO disclosed
CN-1753889-A Quinazoline compounds ASTRAZENECA AB (SE) 2006-03-29 CN disclosed
WO-2005090357-A1 TRICYCLIC BENZOPYRAN COMPOUND AS ANTI-ARRHYTHMIC AGENTS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2005-09-29 WO disclosed
EP-1058549-A4 THROMBIN OR FACTOR Xa INHIBITORS BRISTOL MYERS SQUIBB PHARMA CO (US) 2003-11-12 EP disclosed
US-6602871-B2 Anticoagulants; compounds of given formula: several types of nitrogen containing heterocycles such as perhydroindolizine, piperazine, pyrimidine BRISTOL-MYERS SQUIBB PHARMA COMPANY 2003-08-05 US disclosed
US-20020115854-A1 Thrombin or factor Xa inhibitors LAM PATRICK Y S (US) 2002-08-22 US disclosed
EP-1058549-A1 THROMBIN OR FACTOR Xa INHIBITORS Du Pont Pharmaceuticals Company (US) 2000-12-13 EP disclosed
WO-2000038683-A1 THROMBIN OR FACTOR Xa INHIBITORS DU PONT PHARMACEUTICALS COMPANY (US) 2000-07-06 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 (4 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-20020115854-A1 Thrombin or factor Xa inhibitors SERPINC1, TFPI, SPINT2 EGFR 2920/4885MEN1 1557/4885F2 6/4885
US-20230165885-A1 TREATMENT OF EYE DISORDERS WITH URIDINE PHOSPHATE DERIVATIVES P2RY6, P2RY1, P2RY2 EGFR 3409/4885MEN1 4182/4885F2 4143/4885
US-11802120-B2 Fused cyclic urea derivatives as CRHR2 antagonist CRHR2, CRHR1, CRH EGFR 4159/4885MEN1 2330/4885F2 3784/4885
US-20060116368-A1 4-Piperidinecarboxamide modulators of vanilloid VR1 receptor VDAC1, TRPV1, HVCN1 EGFR 2329/4885MEN1 4809/4885F2 4842/4885

“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.