SCHEMBL5664802

SCHEMBL5664802

COCCOc1nc(C2=C(N)C(=O)C=CC2=O)c2ccccc2n1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 4/20 0.40
NUDT1 P36639 2/20 0.40
ALDH1A1 P00352 2/20 0.39
POLB P06746 1/20 0.39
NCF1 P14598 5/20 0.38
TSHR P16473 1/20 0.37
SCN9A Q15858 1/20 0.37
LMNA P02545 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MPO P05164 1/20 0.36
ADORA2A P29274 2/20 0.34
ELANE P08246 1/20 0.34
KDM1A O60341 1/20 0.34

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
SCHEMBL5134655 0.84 TLR7 (0.38) TLR7NUDT1ALDH1A1POLBNCF1
SCHEMBL28872949 0.78 SCN9A (0.52) NUDT1ALDH1A1TSHRSCN9ALMNA
SCHEMBL3023761 0.76 TLR7 (0.50) TLR7NUDT1NCF1TSHRMPO
Hydrochloric Acid SCHEMBL3231113 0.75 TLR7 (0.49) TLR7NUDT1NCF1TSHRMPO
SCHEMBL28484277 0.73 TSHR (0.43) TLR7NUDT1ALDH1A1POLBNCF1
SCHEMBL5665202 0.72 KDR (0.42) KDM1A
SCHEMBL27945207 0.72 TSHR (0.55) ALDH1A1POLBNCF1TSHRL3MBTL1
SCHEMBL6380647 0.72 TLR7 (0.45) TLR7NUDT1NCF1TSHRMPO
SCHEMBL8682782 0.71 TSHR (0.46) TLR7NUDT1ALDH1A1POLBNCF1
SCHEMBL5664809 0.69 LDHA (0.40) TSHRL3MBTL1MPOADORA2AKDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070299092-A1 Quinone Substituted Quinazoline and Quinoline Kinase Inhibitors WYETH (US) 2007-12-27 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-20070299092-A1 Quinone Substituted Quinazoline and Quinoline Kinase Inhibitors KDR, FLT1, FLT4 TLR7 1532/4885NUDT1 1602/4885ALDH1A1 530/4885

“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.