SCHEMBL6979770

SCHEMBL6979770

O=c1c2ccccc2n(CCCn2ccnc2)c(=O)n1-c1cccc(C(F)(F)F)c1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FNTA P49354 1/20 0.46
FNTB P49356 1/20 0.46
TSHR P16473 1/20 0.45
MAPT P10636 1/20 0.45
GAA P10253 1/20 0.44
KMT2A Q03164 1/20 0.44
QPCT Q16769 1/20 0.44
PGR P06401 1/20 0.43
CYP19A1 P11511 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL6980301 0.92 TSHR (0.46) FNTAFNTBTSHRGAAKMT2A
SCHEMBL6973665 0.89 CYP19A1 (0.50) TSHRMAPTGAAKMT2AQPCT
SCHEMBL6981540 0.87 TSHR (0.47) TSHRGAAKMT2AQPCTPGR
SCHEMBL6979105 0.86 CYP1A2 (0.52) TSHRMAPTGAAKMT2AQPCT
SCHEMBL6977516 0.86 PGR (0.58) TSHRGAAKMT2AQPCTPGR
SCHEMBL6979415 0.85 TSHR (0.49) FNTAFNTBTSHRGAAKMT2A
SCHEMBL6982445 0.84 TSHR (0.52) TSHRMAPTGAAKMT2AQPCT
SCHEMBL6976681 0.83 ALDH1A1 (0.46) FNTAFNTBTSHRGAAKMT2A
SCHEMBL6979316 0.83 TSHR (0.47) TSHRGAAKMT2AQPCTPGR
SCHEMBL6979646 0.83 TSHR (0.52) TSHRGAAKMT2AQPCTPGR

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 FNTA 3523/4885FNTB 2318/4885TSHR 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.