SCHEMBL6982033

SCHEMBL6982033

O=c1[nH]c2ccccc2c(=O)n1Cc1ccccn1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.64
KDM4E B2RXH2 5/20 0.64
HPGD P15428 4/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
AGTR1 P30556 2/20 0.59
CYP1A2 P05177 1/20 0.57
HSD17B10 Q99714 4/20 0.56
TSHR P16473 1/20 0.56
MAPK10 P53779 1/20 0.52
POLB P06746 1/20 0.50
MAPK1 P28482 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
GAA P10253 1/20 0.48
MAPT P10636 1/20 0.48
CASP1 P29466 1/20 0.48
CASP7 P55210 1/20 0.48

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
SCHEMBL4293641 0.82 LMNA (0.56) ALDH1A1HPGDSMN1; SMN2CYP1A2TSHR
SCHEMBL30615329 0.82 LMNA (0.56) ALDH1A1HPGDSMN1; SMN2CYP1A2TSHR
SCHEMBL31359005 0.79 POLB (0.57) ALDH1A1KDM4EHPGDSMN1; SMN2HSD17B10
SCHEMBL30877025 0.79 HPGD (1.00) ALDH1A1KDM4EHPGDSMN1; SMN2CYP1A2
SCHEMBL6982894 0.79 HPGD (1.00) ALDH1A1KDM4EHPGDSMN1; SMN2CYP1A2
SCHEMBL14123133 0.79 GRIN1 (0.53) ALDH1A1AGTR1MEN1KMT2A
SCHEMBL6980977 0.76 PKM (0.79) ALDH1A1KDM4EHPGDSMN1; SMN2CYP1A2
SCHEMBL24439067 0.75 ALDH1A1 (0.54) ALDH1A1KDM4EHPGDAGTR1HSD17B10
SCHEMBL29674703 0.75 ALDH1A1 (0.54) ALDH1A1KDM4EHPGDAGTR1HSD17B10
SCHEMBL7322530 0.74 GABRA5 (0.53) ALDH1A1KDM4EAGTR1HSD17B10MEN1

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 ALDH1A1 331/4885KDM4E 4217/4885HPGD 1378/4885

“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.