SCHEMBL7099735

SCHEMBL7099735

COc1ccc(CNC(=O)c2ccc3c(c2)c(=O)n(Cc2cccc(C#N)c2)c(=O)n3C)cc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.51
RORC P51449 1/20 0.48
ADORA2A P29274 1/20 0.48
MAPT P10636 6/20 0.47
MMP13 P45452 2/20 0.47
KLKB1 P03952 1/20 0.47
KLK1 P06870 1/20 0.47
SLC22A8 Q8TCC7 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
PPARG P37231 1/20 0.46
PARG Q86W56 1/20 0.46
ROCK2 O75116 2/20 0.46
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.45
GRIN1 Q05586 1/20 0.45
GRIN2B Q13224 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
SCHEMBL6258857 0.92 MMP13 (0.51) RXFP1MAPTMMP13SLC22A8SMN1; SMN2
SCHEMBL7014327 0.90 MAPT (0.58) RXFP1MAPTMMP13SMN1; SMN2PPARG
SCHEMBL6246256 0.88 MAPT (0.58) RXFP1MAPTMMP13SLC22A8SMN1; SMN2
SCHEMBL6234634 0.88 MMP13 (0.58) RXFP1MAPTMMP13SMN1; SMN2PPARG
SCHEMBL6437738 0.87 RXFP1 (0.53) RXFP1MAPTMMP13SMN1; SMN2PPARG
SCHEMBL6254595 0.87 POLB (0.54) RXFP1MAPTMMP13SMN1; SMN2PPARG
SCHEMBL7625585 0.87 MMP13 (0.53) RXFP1MAPTMMP13SLC22A8SMN1; SMN2
SCHEMBL6260402 0.85 KLKB1 (0.55) RXFP1MAPTMMP13KLKB1SMN1; SMN2
SCHEMBL7097679 0.85 MMP13 (0.60) RORCMAPTMMP13SLC22A8SMN1; SMN2
SCHEMBL6259580 0.84 MMP13 (0.61) RXFP1MAPTMMP13SLC22A8PPARG

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 claimed
US-20020193377-A1 Quinazolines as MMP-13 inhibitors ANDRIANJARA CHARLES (FR) 2002-12-19 US claimed
WO-2002064572-A1 QUINAZOLINES AS MMP-13 INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-08-22 WO claimed

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 RXFP1 83/4885RORC 1297/4885ADORA2A 1982/4885

“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.