SCHEMBL5539880

SCHEMBL5539880

COC(=O)C=Cc1ccccc1N=C=Nc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.41
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 4/20 0.41
KMT2A Q03164 3/20 0.41
HPGD P15428 2/20 0.41
MEN1 O00255 1/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
ALOX15 P16050 1/20 0.41
CYP2C19 P33261 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NFE2L2 Q16236 2/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
TYR P14679 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39

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
SCHEMBL5539874 1.00 MAPT (0.41) MAPTALDH1A1KDM4EKMT2AHPGD
SCHEMBL2689048 0.92 IP6K1 (0.39) MAPTALDH1A1KDM4EKMT2AHPGD
SCHEMBL2689049 0.92 IP6K1 (0.39) MAPTALDH1A1KDM4EKMT2AHPGD
SCHEMBL15554506 0.90 NFE2L2 (0.39) MAPTALDH1A1KDM4EKMT2AHPGD
SCHEMBL15555761 0.90 MAPT (0.38) MAPTALDH1A1KDM4EKMT2AHPGD
SCHEMBL15555762 0.90 MAPT (0.38) MAPTALDH1A1KDM4EKMT2AHPGD
SCHEMBL15554877 0.89 ALDH1A1 (0.37) MAPTALDH1A1KDM4EKMT2AHPGD
SCHEMBL15554262 0.86 CCNC (0.37) MAPTALDH1A1KDM4EKMT2AHPGD
SCHEMBL15555463 0.85 CCNC (0.47) MAPTALDH1A1KDM4EKMT2AHPGD
SCHEMBL28224850 0.84 ALDH1A1 (0.44) MAPTALDH1A1KDM4EKMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1568695-B1 3,4-Dihydroquinazoline derivatives as T-type calcium channel blockers and method of preparing the same KOREA INST SCI & TECH (KR) 2016-03-09 EP disclosed
US-7271260-B2 3,4-dihydroquinazoline derivatives as T-type calcium channel blockers and method of preparing the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2007-09-18 US disclosed
US-20050197351-A1 3,4-Dihydroquinazoline derivatives as T-type calcium channel blockers and method of preparing the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2005-09-08 US disclosed
EP-1568695-A1 3,4-Dihydroquinazoline derivatives as T-type calcium channel blockers and method of preparing the same Korea Institute of Science and Technology (KR) 2005-08-31 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 (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-20050197351-A1 3,4-Dihydroquinazoline derivatives as T-type calcium channel blockers and method of preparing the same CACNA1I, CACNA1G, CACNA1H MAPT 429/4885ALDH1A1 3052/4885KDM4E 944/4885

“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.