SCHEMBL5651020

SCHEMBL5651020

COc1cc2ncnc(N3CCCC(N4CCCCC4=O)C3=O)c2cc1OC

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RET P07949 2/20 0.47
EGFR P00533 2/20 0.47
CSF1R P07333 1/20 0.46
ENPP1 P22413 8/20 0.46
PDE3A Q14432 1/20 0.46
AURKA O14965 1/20 0.46
ACHE P22303 3/20 0.45
BACE1 P56817 3/20 0.45
PDE10A Q9Y233 2/20 0.44
KIF5B P33176 1/20 0.44
KDR P35968 1/20 0.44
MAPK1 P28482 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
SCHEMBL5479465 0.83 HCRTR1 (0.39)
SCHEMBL4717971 0.83 NCF1 (0.47) PDE3AKDR
SCHEMBL5651013 0.80 PDE3A (0.60) ENPP1PDE3AACHEBACE1PDE10A
SCHEMBL5653869 0.79 PDE10A (0.38) PDE10A
SCHEMBL5654216 0.79 PDE10A (0.38) PDE10A
SCHEMBL4164655 0.79 PDE10A (0.38) PDE10A
SCHEMBL5653295 0.79 PDE10A (0.38) PDE10A
SCHEMBL22445562 0.70 ENPP1 (0.50) ENPP1PDE3AAURKAACHEBACE1
SCHEMBL4717907 0.70 EGFR (0.85) RETEGFRCSF1RPDE3AACHE
SCHEMBL3873291 0.70 ACHE (0.78) ENPP1PDE3AAURKAACHEBACE1

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-20070265258-A1 Quinazoline derivatives as phosphodiesterase 10 inhibitors AMGEN INC. 2007-11-15 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-20070265258-A1 Quinazoline derivatives as phosphodiesterase 10 inhibitors PDE12, PDE5A, PDE7A RET 3179/4885EGFR 4704/4885CSF1R 3501/4885

“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.