SCHEMBL13313299

SCHEMBL13313299

CCc1cnc2cccc(O)c2n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.52
KMT2A Q03164 2/20 0.47
MAPT P10636 2/20 0.47
ALDH1A1 P00352 1/20 0.47
GAA P10253 1/20 0.47
RAB9A P51151 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
PDE10A Q9Y233 5/20 0.45
KDM4E B2RXH2 4/20 0.41
NQO2 P16083 1/20 0.41
PDE4D Q08499 1/20 0.40
METAP2 P50579 2/20 0.39
TSHR P16473 2/20 0.39
MMP2 P08253 1/20 0.39
CHRM1 P11229 1/20 0.39
COMT P21964 1/20 0.39
ADRA1A P35348 1/20 0.39
METAP1 P53582 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
CYP1A2 P05177 2/20 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
SCHEMBL13271193 0.83 ACHE (0.52) ACHEKMT2AMAPTALDH1A1GAA
SCHEMBL13271204 0.82 ACHE (0.47) ACHEKMT2AMAPTALDH1A1GAA
SCHEMBL13313316 0.78 KDM4E (0.38) KMT2APDE10AKDM4ENQO2PDE4D
SCHEMBL13439500 0.78 ACHE (0.46) ACHEKMT2AMAPTALDH1A1GAA
SCHEMBL13348662 0.77 ACHE (0.42) ACHEKMT2AMAPTALDH1A1GAA
SCHEMBL1041134 0.77 ACHE (0.57) ACHEKMT2AMAPTALDH1A1GAA
SCHEMBL13348677 0.76 ACHE (0.44) ACHEKMT2AMAPTALDH1A1GAA
SCHEMBL13439508 0.76 ACHE (0.41) ACHEKMT2AMAPTALDH1A1GAA
SCHEMBL31694655 0.74 PDE10A (0.69) KMT2AMAPTALDH1A1RAB9APDE10A
SCHEMBL5792272 0.74 PDE10A (0.69) KMT2AMAPTALDH1A1RAB9APDE10A

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-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

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 ACHE 1/4885KMT2A 2765/4885MAPT 5/4885

“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.