SCHEMBL6979128

SCHEMBL6979128

O=c1c2ccccc2n(CCCn2ccnc2)c(=O)n1-c1ccc(Br)cc1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.51
QPCT Q16769 1/20 0.51
TSHR P16473 2/20 0.49
GAA P10253 1/20 0.48
PGR P06401 3/20 0.48
HMOX1 P09601 1/20 0.44

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
SCHEMBL6977516 0.91 PGR (0.58) KMT2AQPCTTSHRGAAPGR
SCHEMBL6979646 0.90 TSHR (0.52) KMT2AQPCTTSHRGAAPGR
SCHEMBL6980755 0.89 TSHR (0.54) KMT2AQPCTTSHRGAAPGR
SCHEMBL6981436 0.89 CYP1A2 (0.51) KMT2AQPCTTSHRGAAPGR
SCHEMBL6978590 0.89 QPCT (0.49) KMT2AQPCTTSHRGAAPGR
SCHEMBL6976593 0.89 TSHR (0.49) KMT2AQPCTTSHRGAAPGR
SCHEMBL6979415 0.89 TSHR (0.49) KMT2AQPCTTSHRGAAPGR
Hydrochloric Acid SCHEMBL7127430 0.88 TSHR (0.48) KMT2AQPCTTSHRGAAPGR
SCHEMBL6981544 0.88 TSHR (0.50) KMT2AQPCTTSHRGAAPGR
SCHEMBL6977928 0.87 TSHR (0.47) KMT2AQPCTTSHRGAAPGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030199530-A1 New compounds derived from quinazoline LES LABORATORIES SERVIER (FR) 2003-10-23 US disclosed
EP-1346992-A1 Quinazoline derivatives, process for their preparation and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2003-09-24 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-20030199530-A1 New compounds derived from quinazoline NQO2, XDH, DRD1 KMT2A 2578/4885QPCT 263/4885TSHR 3090/4885

“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.