SCHEMBL4875674

SCHEMBL4875674

[c]1nc2ccccc2cc1-c1nsc2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.39
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 2/20 0.39
HSD17B10 Q99714 2/20 0.39
EPAS1 Q99814 8/20 0.34
GLA P06280 1/20 0.33
HPGD P15428 1/20 0.33
ACHE P22303 1/20 0.33
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
DRD2 P14416 1/20 0.31
DRD4 P21917 1/20 0.31
DRD3 P35462 1/20 0.31
GRM2 Q14416 1/20 0.31
MEN1 O00255 1/20 0.30
TP53 P04637 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
PKM P14618 1/20 0.30

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
SCHEMBL976828 0.75 ITK (0.50) KDM4EALDH1A1HPGDNPC1RAB9A
SCHEMBL2187375 0.74 KMT2A (0.42) MAPTKDM4EALDH1A1HSD17B10GLA
SCHEMBL3933846 0.74 KDM4E (0.41) MAPTKDM4EALDH1A1HSD17B10GLA
SCHEMBL4324936 0.73 APP (0.44) MAPTALDH1A1GLAHPGDACHE
SCHEMBL10640426 0.73 KDM4E (0.38) MAPTKDM4EALDH1A1GLAHPGD
SCHEMBL2893870 0.72 RAB9A (0.46) MAPTKDM4EALDH1A1HSD17B10GLA
SCHEMBL30987223 0.72 MAPT (0.60) MAPTKDM4EALDH1A1HSD17B10EPAS1
SCHEMBL28563540 0.72 MAPT (0.60) MAPTKDM4EALDH1A1HSD17B10EPAS1
SCHEMBL5516956 0.72 ESR1 (0.44) MAPTKDM4EALDH1A1GLAHPGD
SCHEMBL628270 0.70 ALDH1A1 (0.43) MAPTKDM4EALDH1A1GLAHPGD

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-7449570-B2 Use of nucleoside compounds for nonsense suppression and the treatment of genetic diseases PTC THERAPEUTICS, INC. (US) 2008-11-11 US disclosed
US-20060166926-A1 Use of nucleoside compounds for nonsense suppression and the treatment of genetic diseases PTC THERAPEUTICS, INC. 2006-07-27 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-20060166926-A1 Use of nucleoside compounds for nonsense suppression and the treatment of genetic diseases NSUN2, UPF1, NSUN3 MAPT 3685/4885KDM4E 2311/4885ALDH1A1 2951/4885

“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.