SCHEMBL13313428

SCHEMBL13313428

NCc1ccc2cncc(O)c2n1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.36
CCR1 P32246 2/20 0.36
PLAU P00749 1/20 0.32
NCF1 P14598 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31

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
SCHEMBL2522559 0.76 PLAU (0.58) PDE10ACCR1PLAUNCF1KDM4E
Hydrochloric Acid SCHEMBL1978354 0.74 PLAU (0.56) PDE10ACCR1PLAUNCF1KDM4E
SCHEMBL13313421 0.73 CCR1 (0.35) CCR1
SCHEMBL14610932 0.73 CCR1 (0.56) PDE10ACCR1KDM4EMAPT
SCHEMBL3243143 0.71 METAP2 (0.57) CCR1KDM4EALDH1A1MAPT
Perchlorate SCHEMBL9561770 0.67 CCR1 (0.56) CCR1
SCHEMBL13348672 0.67 ALDH1A1 (0.42) KDM4EALDH1A1MAPT
SCHEMBL13313430 0.67 SOS2 (0.61)
SCHEMBL13313432 0.67 CCR1 (0.55) CCR1KDM4EALDH1A1MAPT
SCHEMBL13313431 0.67 KDM4E (0.61) KDM4EALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100160346-A1 NEUROLOGICALLY ACTIVE COMPOUNDS PRANA BIOTECHNOLOGY LIMITED (AU) 2010-06-24 US disclosed
US-20100160346-A1 NEUROLOGICALLY ACTIVE COMPOUNDS PRANA BIOTECHNOLOGY LIMITED (AU) 2010-06-24 US disclosed
US-7692011-B2 8-hydroxy and 8-mercapto quinazolinones PRANA BIOTECHNOLOGY LIMITED (AU) 2010-04-06 US disclosed
US-7692011-B2 8-hydroxy and 8-mercapto quinazolinones PRANA BIOTECHNOLOGY LIMITED (AU) 2010-04-06 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-20100160346-A1 NEUROLOGICALLY ACTIVE COMPOUNDS ACHE, PSEN1, PSEN2 PDE10A 1284/4885CCR1 4660/4885PLAU 2406/4885

“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.