SCHEMBL5463191

SCHEMBL5463191

CCOc1ccccc1C1CC(=O)c2c(C)nc(N)nc2C1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 6/20 0.62
HSP90AB1 P08238 6/20 0.62
ALDH1A1 P00352 4/20 0.42
MAPT P10636 3/20 0.42
HPGD P15428 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.38
TRAP1 Q12931 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
USP2 O75604 1/20 0.37
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL1779006 0.87 HSP90AA1 (0.66) HSP90AA1HSP90AB1ALDH1A1MAPTHPGD
SCHEMBL4618394 0.85 HSP90AA1 (0.60) HSP90AA1HSP90AB1ALDH1A1MAPTHPGD
SCHEMBL5471332 0.84 HSP90AA1 (0.62) HSP90AA1HSP90AB1ALDH1A1HPGDSMN1; SMN2
SCHEMBL4620866 0.84 HSP90AA1 (0.65) HSP90AA1HSP90AB1ALDH1A1MAPTHPGD
SCHEMBL5470543 0.84 HSP90AA1 (0.62) HSP90AA1HSP90AB1ALDH1A1HPGDSMN1; SMN2
SCHEMBL4619857 0.84 HSP90AA1 (0.67) HSP90AA1HSP90AB1ALDH1A1MAPTHPGD
SCHEMBL5464191 0.83 HSP90AA1 (0.53) HSP90AA1HSP90AB1ALDH1A1MAPTHPGD
SCHEMBL5458097 0.83 HSP90AA1 (0.57) HSP90AA1HSP90AB1ALDH1A1MAPTHPGD
SCHEMBL14582379 0.83 HSP90AA1 (0.60) HSP90AA1HSP90AB1ALDH1A1HPGDSMN1; SMN2
SCHEMBL5465114 0.83 HSP90AA1 (0.60) HSP90AA1HSP90AB1ALDH1A1MAPTHPGD

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
US-20070027150-A1 2-Amino-quinazolin-5-ones NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2007-02-01 US disclosed
US-20070027150-A1 2-Amino-quinazolin-5-ones NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2007-02-01 US disclosed
US-20070027150-A1 2-Amino-quinazolin-5-ones NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2007-02-01 US 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-20070027150-A1 2-Amino-quinazolin-5-ones TK1, TK2, SLC1A5 HSP90AA1 3373/4885HSP90AB1 3036/4885ALDH1A1 1718/4885

“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.