SCHEMBL3759182

SCHEMBL3759182

CNS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.50
MEN1 O00255 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C19 P33261 1/20 0.50
KMT2A Q03164 1/20 0.50
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MAPT P10636 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL3757316 0.90 GLS (0.49) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL1860103 0.81 CHRM2 (0.54) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL10898704 0.81 CHRM2 (0.48) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL918303 0.78 TDP1 (0.51) CYP1A2CYP2C19TDP1L3MBTL1MAPT
SCHEMBL30173785 0.78 GLS (0.55) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL2286757 0.78 TDP1 (0.51) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL3418095 0.78 GLS (0.55) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL1863859 0.77 MAOB (0.52) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL2284215 0.77 TDP1 (0.50) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL5839787 0.77 TDP1 (0.54) CHRM2MEN1CYP1A2CYP2C19KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2238119-B1 Quinazolines and related heterocyclic compounds, and their therapeutic use VERENIGING VOOR CHRISTELIJK HOGER ONDERWIJS WETENSCHAPPELIJK ONDERZOEK EN PATIËNTENZORG (NL) 2015-11-25 EP disclosed
US-8530486-B2 Quinazolines and related heterocyclic compounds, and their therapeutic use VERENIGING VOOR CHRISTELIJK HOGER ONDERWIJS, WETENSCHAPPELIJK ONDERZOEK EN PATIENTENZORG (NL) 2013-09-10 US disclosed
US-7910611-B2 Therapeutic agent for restenosis KYOWA HAKKO KIRIN CO., LTD. (JP) 2011-03-22 US disclosed
US-20100298322-A1 Quinazolines and Related Heterocyclic Compounds, and Their Therapeutic Use VERENIGING VOOR CHRISTELIJK, WETENSCHAPPELIJK ONDERZOEK EN PATIENTENZORG (NL) 2010-11-25 US disclosed
US-20100029625-A1 Therapeutic Agent for Restenosis KYOWA HAKKO KIRIN CO., LTD. (JP) 2010-02-04 US disclosed
EP-2077263-A1 Quinazolines and related heterocyclic compounds and their therapeutic use Vereniging voor christelijk hoger onderwijs, wetenschappelijk onderzoek en patiëntenzorg (NL) 2009-07-08 EP 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 (2 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-20100298322-A1 Quinazolines and Related Heterocyclic Compounds, and Their Therapeutic Use RXFP3, RXFP1, NR1I3 CHRM2 23/4885MEN1 1483/4885CYP1A2 373/4885
US-20100029625-A1 Therapeutic Agent for Restenosis NR1H2, NR1H3, LDLR CHRM2 1264/4885MEN1 4098/4885CYP1A2 1325/4885

“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.