SCHEMBL4334092

SCHEMBL4334092

CCOC(=O)CCNCc1ccc(-c2ccc3ncnc(Nc4ccc(OCc5cccc(F)c5)c(Cl)c4)c3c2)o1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 15/20 0.77
ERBB2 P04626 10/20 0.77
ABCB11 O95342 2/20 0.77
MEN1 O00255 1/20 0.77
PIK3C2B O00750 1/20 0.77
MAP2K7 O14733 1/20 0.77
RIPK2 O43353 1/20 0.77
PIK3C2G O75747 1/20 0.77
STK10 O94804 1/20 0.77
ABL1 P00519 1/20 0.77
INSR P06213 1/20 0.77
RET P07949 1/20 0.77
CYP3A4 P08684 1/20 0.77
PDGFRB P09619 1/20 0.77
SRC P12931 1/20 0.77
CYP3A5 P20815 1/20 0.77
ERBB3 P21860 1/20 0.77
CDK2 P24941 1/20 0.77
KMT2A Q03164 1/20 0.77
KCNH2 Q12809 1/20 0.77

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
SCHEMBL15766158 0.97 EGFR (0.79) EGFRERBB2ABCB11MEN1PIK3C2B
SCHEMBL4337630 0.95 HDAC3 (0.83) EGFRERBB2ABCB11MEN1PIK3C2B
SCHEMBL15766048 0.94 ABCB11 (0.83) EGFRERBB2ABCB11MEN1PIK3C2B
SCHEMBL13538227 0.92 HDAC3 (0.78) EGFRERBB2ABCB11MEN1PIK3C2B
SCHEMBL8210205 0.91 EGFR (0.80) EGFRERBB2ABCB11MEN1PIK3C2B
SCHEMBL12727523 0.91 EGFR (0.87) EGFRERBB2ABCB11MEN1PIK3C2B
SCHEMBL4740260 0.90 HDAC3 (0.90) EGFRERBB2ABCB11MEN1PIK3C2B
SCHEMBL22336743 0.89 EGFR (0.84) EGFRERBB2ABCB11MEN1PIK3C2B
SCHEMBL4338870 0.89 HDAC3 (0.86) EGFRERBB2ABCB11MEN1PIK3C2B
SCHEMBL11897347 0.89 EGFR (0.81) EGFRERBB2ABCB11MEN1PIK3C2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9499530-B2 Quinazoline derivative, composition having the derivative, and use of the derivative in preparing medicament HANGZHOU MINSHENG INSTITUTES FOR PHARMA RESEARCH (CN) 2016-11-22 US claimed
US-20150080392-A1 QUINAZOLINE DERIVATIVE, COMPOSITION HAVING THE DERIVATIVE, AND USE OF THE DERIVATIVE IN PREPARING MEDICAMENT HANGZHOU MINSHENG PHARMACEUTICAL CO. LTD (CN) 2015-03-19 US claimed
EP-2740729-A1 QUINAZOLINE DERIVATIVE, COMPOSITION HAVING THE DERIVATIVE, AND USE OF THE DERIVATIVE IN PREPARING MEDICAMENT Hangzhou Minsheng Institutes for Pharma Research (CN) 2014-06-11 EP claimed
US-11753407-B2 Compounds for treating spinal muscular atrophy PTC THERAPEUTICS, INC. (US) 2023-09-12 US disclosed
US-20210276999-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY HOFFMANN-LA ROCHE INC. 2021-09-09 US disclosed
EP-2740729-B1 QUINAZOLINE DERIVATIVE, COMPOSITION HAVING THE DERIVATIVE, AND USE OF THE DERIVATIVE IN PREPARING MEDICAMENT HANGZHOU MINSHENG INSTITUTES FOR PHARMA RES (CN) 2020-11-25 EP disclosed
US-9914722-B2 Compounds for treating spinal muscular atrophy PTC THERAPEUTICS, INC. (US) 2018-03-13 US disclosed
US-9499530-B2 Quinazoline derivative, composition having the derivative, and use of the derivative in preparing medicament HANGZHOU MINSHENG INSTITUTES FOR PHARMA RESEARCH (CN) 2016-11-22 US disclosed
US-20150284340-A1 QUINAZOLINE BASED EGFR INHIBITORS CONTAINING A ZINC BINDING MOIETY CURIS INC (US) 2015-10-08 US disclosed
US-9024024-B2 Quinazoline based EGFR inhibitors containing a zinc binding moiety CURIS, INC. (US) 2015-05-05 US disclosed
US-20150119380-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY F. HOFFMANN-LA ROCHE AG (CH) 2015-04-30 US disclosed
EP-2740729-A1 QUINAZOLINE DERIVATIVE, COMPOSITION HAVING THE DERIVATIVE, AND USE OF THE DERIVATIVE IN PREPARING MEDICAMENT Hangzhou Minsheng Institutes for Pharma Research (CN) 2014-06-11 EP disclosed
US-8604044-B2 Quinazoline based EGFR inhibitors containing a zinc binding moiety CURIS, INC. (US) 2013-12-10 US disclosed
EP-2061772-A2 MULTI-FUNCTIONAL SMALL MOLECULES AS ANTI-PROLIFERATIVE AGENTS Curis, Inc. (US) 2009-05-27 EP disclosed
EP-2061773-A2 QUINAZOLINE BASED EGFR INHIBITORS CONTAINING A ZINC BINDING MOIETY Curis, Inc. (US) 2009-05-27 EP disclosed
US-20080221132-A1 Multi-Functional Small Molecules as Anti-Proliferative Agents CURIS, INC. 2008-09-11 US disclosed
US-20080194578-A1 inhibitors of epidermal growth factor receptor tyrosine kinase and histone deacetylase; 2-(4-(3-Chloro-4-fluorophenylamino)-7-methoxyquinazolin-6-yloxy)-N-hydroxyacetamide; anticarcinogenic agent CURIS, INC. 2008-08-14 US disclosed
WO-2008033747-A9 MULTI-FUNCTIONAL SMALL MOLECULES AS ANTI-PROLIFERATIVE AGENTS CURIS INC (MA) 2008-07-24 WO disclosed
WO-2008033749-A2 QUINAZOLINE BASED EGFR INHIBITORS CONTAINING A ZINC BINDING MOIETY CURIS, INC. (US) 2008-03-20 WO disclosed
WO-2008033747-A2 MULTI-FUNCTIONAL SMALL MOLECULES AS ANTI-PROLIFERATIVE AGENTS CURIS, INC. (US) 2008-03-20 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 (7 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-20080221132-A1 Multi-Functional Small Molecules as Anti-Proliferative Agents HDAC1, HDAC6, HDAC5 EGFR 2358/4885ERBB2 2794/4885ABCB11 4419/4885
US-20080194578-A1 inhibitors of epidermal growth factor receptor tyrosine kinase and histone deacetylase; 2-(4-(3-Chloro-4-fluorophenylamino)-7-methoxyquinazolin-6-yloxy)-N-hydroxyacetamide; anticarcinogenic agent HDAC1, HDAC8, EGFR EGFR 3/4885ERBB2 9/4885ABCB11 4645/4885
US-20150119380-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY SMN1; SMN2, RBM17, RBM22 EGFR 4684/4885ERBB2 4490/4885ABCB11 4721/4885
US-20210276999-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY SMN1; SMN2, CPT1B, GYS1 EGFR 4794/4885ERBB2 4825/4885ABCB11 3473/4885
US-20150080392-A1 QUINAZOLINE DERIVATIVE, COMPOSITION HAVING THE DERIVATIVE, AND USE OF THE DERIVATIVE IN PREPARING MEDICAMENT LCK, ZAP70, FYN EGFR 24/4885ERBB2 6/4885ABCB11 4157/4885
US-20150284340-A1 QUINAZOLINE BASED EGFR INHIBITORS CONTAINING A ZINC BINDING MOIETY EGFR, ERBB4, HDAC5 EGFR 1/4885ERBB2 7/4885ABCB11 2855/4885
US-11753407-B2 Compounds for treating spinal muscular atrophy SMN1; SMN2, CPT1B, GYS1 EGFR 4595/4885ERBB2 4756/4885ABCB11 4115/4885

“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.