SCHEMBL13348552

SCHEMBL13348552

COOCc1ncc2cccnc2c1OC(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
POLB P06746 1/20 0.43
LMNA P02545 4/20 0.36
RAB9A P51151 3/20 0.36
NPC1 O15118 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 6/20 0.34
MAPT P10636 5/20 0.34
TRPM8 Q7Z2W7 1/20 0.32
CYP3A4 P08684 3/20 0.32
CYP2D6 P10635 3/20 0.32
HSP90AA1 P07900 3/20 0.32
TP53 P04637 2/20 0.32
HIF1A Q16665 2/20 0.32
GMNN O75496 1/20 0.32
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL13348550 0.78 FEN1 (0.40) MEN1KMT2APOLBRAB9ANPC1
SCHEMBL3246298 0.75 MEN1 (0.46) MEN1KMT2APOLBLMNARAB9A
SCHEMBL3232011 0.75 POLB (0.46) MEN1KMT2APOLBLMNARAB9A
SCHEMBL3244917 0.71 KDM4E (0.44) MEN1KMT2APOLBLMNASMN1; SMN2
SCHEMBL28757969 0.70 FEN1 (0.43) MEN1KMT2APOLBLMNAKDM4E
SCHEMBL3232404 0.69 MAPT (0.45) MEN1KMT2APOLBRAB9ANPC1
SCHEMBL13313522 0.68 KDM4E (0.41) MEN1KMT2APOLBLMNAKDM4E
SCHEMBL27399036 0.68 L3MBTL1 (0.52) MEN1KMT2APOLBRAB9ANPC1
SCHEMBL3242228 0.66 PIK3CA (0.44) TRPM8MTORCYP1A2
SCHEMBL1101672 0.62 MEN1 (0.72) MEN1KMT2APOLBLMNARAB9A

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 MEN1 1991/4885KMT2A 2765/4885POLB 2953/4885

“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.