SCHEMBL6981013

SCHEMBL6981013

Cc1cccc(-n2c(=O)c3ccccc3n(CCCn3ccnc3)c2=O)c1C

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.52
QPCT Q16769 2/20 0.48
GSK3B P49841 1/20 0.48
GAA P10253 1/20 0.48
KMT2A Q03164 3/20 0.46
ALDH1A1 P00352 2/20 0.45
MAPK1 P28482 2/20 0.45
PRKCI P41743 1/20 0.44
LMNA P02545 1/20 0.44
HPGD P15428 1/20 0.44
ALOX15 P16050 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MEN1 O00255 2/20 0.44
IDH1 O75874 1/20 0.43
PLK1 P53350 1/20 0.43

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
SCHEMBL6982150 0.87 TSHR (0.52) TSHRQPCTGAAKMT2AALDH1A1
SCHEMBL6977534 0.87 TSHR (0.52) TSHRQPCTGAAKMT2AALDH1A1
SCHEMBL6978222 0.85 TSHR (0.50) TSHRQPCTGSK3BGAAKMT2A
SCHEMBL6972602 0.85 TSHR (0.49) TSHRQPCTGAAKMT2ASMN1; SMN2
SCHEMBL6980842 0.85 TSHR (0.49) TSHRQPCTGAAKMT2AALDH1A1
SCHEMBL6976772 0.84 QPCT (0.51) TSHRQPCTGSK3BGAAKMT2A
SCHEMBL6980747 0.83 TSHR (0.48) TSHRQPCTGAAKMT2AALDH1A1
SCHEMBL6980755 0.82 TSHR (0.54) TSHRQPCTGSK3BGAAKMT2A
SCHEMBL6972018 0.82 TSHR (0.47) TSHRQPCTGAAKMT2AALDH1A1
SCHEMBL6982552 0.82 ALDH1A1 (0.50) TSHRQPCTGSK3BGAAKMT2A

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 TSHR 3090/4885QPCT 263/4885GSK3B 3383/4885

“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.