SCHEMBL7014661

SCHEMBL7014661

NC(=O)O[CH]c1ccnnc1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.38
HSD17B10 Q99714 1/20 0.34
LOXL2 Q9Y4K0 1/20 0.31
KDM4E B2RXH2 1/20 0.31
TBXA2R P21731 2/20 0.30
TBXAS1 P24557 2/20 0.30

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
SCHEMBL7017014 0.77 HCAR2 (0.35) HCAR2HSD17B10LOXL2
SCHEMBL4326419 0.76 HCAR2 (0.43) HCAR2HSD17B10LOXL2KDM4E
SCHEMBL7018498 0.70 HCAR2 (0.38) HCAR2HSD17B10LOXL2KDM4E
SCHEMBL27834761 0.70 MAPT (0.43) HCAR2HSD17B10KDM4E
SCHEMBL27834705 0.68 CYP19A1 (0.41)
SCHEMBL27814966 0.67 CAPN1 (0.41)
SCHEMBL194124 0.66
SCHEMBL12499653 0.65 P4HTM (0.53) HCAR2HSD17B10KDM4ETBXAS1
SCHEMBL12499655 0.65 P4HTM (0.53) HCAR2HSD17B10KDM4ETBXAS1
Hydrochloric Acid SCHEMBL27333803 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1368324-A1 QUINAZOLINES AS MMP-13 INHIBITORS Warner-Lambert Company LLC (US) 2003-12-10 EP disclosed
US-20020193377-A1 Quinazolines as MMP-13 inhibitors ANDRIANJARA CHARLES (FR) 2002-12-19 US disclosed
WO-2002064572-A1 QUINAZOLINES AS MMP-13 INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-08-22 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-20020193377-A1 Quinazolines as MMP-13 inhibitors MMP13, MMP9, MMP3 HCAR2 795/4885HSD17B10 1644/4885LOXL2 684/4885

“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.