SCHEMBL3534600

SCHEMBL3534600

CCOC(=O)c1cc(OC)c(OCCCN2CCOCC2)cc1N

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.51
HTR4 Q13639 4/20 0.50
ALDH1A1 P00352 2/20 0.50
CYP2D6 P10635 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
POLB P06746 1/20 0.50
CYP3A4 P08684 1/20 0.50
HTR3A P46098 1/20 0.50
KDM4E B2RXH2 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
TSHR P16473 2/20 0.46
KEAP1 Q14145 1/20 0.46
NFE2L2 Q16236 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
RAD52 P43351 1/20 0.45
UHRF1 Q96T88 1/20 0.45

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
SCHEMBL6442660 1.00 LMNA (0.51) LMNAHTR4ALDH1A1CYP2D6MEN1
SCHEMBL3471214 0.90 LMNA (0.56) LMNAHTR4ALDH1A1CYP2D6MEN1
SCHEMBL3711173 0.90 LMNA (0.56) LMNAHTR4ALDH1A1CYP2D6MEN1
SCHEMBL6336768 0.89 HTR4 (0.62) HTR4ALDH1A1CYP2D6MEN1KMT2A
SCHEMBL13503072 0.88 POLB (0.50) ALDH1A1POLBKDM4ESMN1; SMN2RAD52
SCHEMBL362445 0.87 LMNA (0.55) LMNAHTR4ALDH1A1CYP2D6MEN1
SCHEMBL5502433 0.87 LMNA (0.55) LMNAHTR4ALDH1A1CYP2D6MEN1
SCHEMBL3284976 0.87 LMNA (0.55) LMNAHTR4ALDH1A1CYP2D6MEN1
SCHEMBL3527664 0.84 ALDH1A1 (0.57) LMNAALDH1A1CYP2D6MEN1KMT2A
SCHEMBL3709691 0.84 ALDH1A1 (0.57) LMNAALDH1A1CYP2D6MEN1KMT2A

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8367824-B2 Reacting anthranilic acid with formic acid compound in presence of a catalyst and solvent UBE INDUSTRIES LTD. (JP) 2013-02-05 US disclosed
US-7709479-B1 Quinazoline derivatives and their use as pharmaceuticals ASTRAZENECA (SE) 2010-05-04 US disclosed
EP-1218354-B1 QUINAZOLINE DERIVATIVES AND THEIR USE AS PHARMACEUTICALS ASTRAZENECA AB (SE) 2009-11-18 EP disclosed
WO-2009103719-A1 SUBSTITUTED 4-(INDOL-3-YL)QUINAZOLINES AND USE AND PRODUCTION THEREOF FREIE UNIVERSITÄT BERLIN (DE) 2009-08-27 WO disclosed
EP-1477481-B1 PROCESS FOR PRODUCING QUINAZOLIN-4-ONE DERIVATIVE UBE INDUSTRIES (JP) 2009-07-22 EP disclosed
US-7235559-B1 Therapeutic quinazoline derivatives ASTRAZENECA AB (SE) 2007-06-26 US disclosed
US-7105669-B1 Quinazoline derivatives ASTRAZENECA AB (SE) 2006-09-12 US disclosed
US-7081461-B1 Quinazoline compounds and pharmaceutical compositions containing them ASTRAZENECA AB (SE) 2006-07-25 US disclosed
US-20050080262-A1 Process for producing quinazolin-4-one derivative UBE INDUSTRIES, LTD. (JP) 2005-04-14 US disclosed
EP-1218357-B1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2005-04-06 EP disclosed
EP-1477481-A1 PROCESS FOR PRODUCING QUINAZOLIN-4-ONE DERIVATIVE Ube Industries, Ltd. (JP) 2004-11-17 EP disclosed
EP-1218355-A1 THERAPEUTIC QUINAZOLINE DERIVATIVES AstraZeneca AB (SE) 2002-07-03 EP disclosed
EP-1218356-A1 QUINAZOLINE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AstraZeneca AB (SE) 2002-07-03 EP disclosed
EP-1218357-A1 QUINAZOLINE DERIVATIVES AstraZeneca AB (SE) 2002-07-03 EP disclosed
EP-1218354-A1 QUINAZOLINE DERIVATIVES AND THEIR USE AS PHARMACEUTICALS AstraZeneca AB (SE) 2002-07-03 EP disclosed
WO-2001021597-A1 THERAPEUTIC QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2001-03-29 WO disclosed
WO-2001021596-A1 QUINAZOLINE DERIVATIVES AND THEIR USE AS PHARMACEUTICALS ASTRAZENECA AB (SE) 2001-03-29 WO disclosed
WO-2001021594-A1 QUINAZOLINE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ASTRAZENECA AB (SE) 2001-03-29 WO disclosed
WO-2001021595-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2001-03-29 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 (1 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-20050080262-A1 Process for producing quinazolin-4-one derivative NQO2, SDHA, CYP3A4 LMNA 3978/4885HTR4 658/4885ALDH1A1 477/4885

“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.