SCHEMBL14554226

SCHEMBL14554226

O=C1Nc2cc(Br)ccc2C1C1Nc2ccccc2C1NO

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.38
CYP1A2 P05177 1/20 0.38
MAPK1 P28482 1/20 0.38
TP53 P04637 3/20 0.36
POLB P06746 1/20 0.36
NQO2 P16083 1/20 0.35
EDNRB P24530 1/20 0.33
EDNRA P25101 1/20 0.33
LMNA P02545 2/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
IDO1 P14902 1/20 0.32
KDM4E B2RXH2 1/20 0.32
CACNB4 O00305 1/20 0.32
CACNA1A O00555 1/20 0.32
CACNA1G O43497 1/20 0.32
CACNG3 O60359 1/20 0.32
CACNA1F O60840 1/20 0.32
CACNA1H O95180 1/20 0.32
CACNB3 P54284 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
SCHEMBL14554230 0.87 IDO1 (0.41) MAPTIDO1KDM4E
SCHEMBL16668782 0.74 CMA1 (0.43) MAPTCYP1A2MAPK1TP53POLB
SCHEMBL16986622 0.74 CYP1A2 (0.42) MAPTCYP1A2MAPK1TP53POLB
SCHEMBL4997975 0.71 DYRK2 (0.52) MAPTCYP1A2MAPK1TP53POLB
SCHEMBL23752444 0.66 MAPT (0.44) MAPTCYP1A2MAPK1TP53POLB
SCHEMBL25057548 0.65 CMA1 (0.41) MAPTCYP1A2MAPK1TP53POLB
SCHEMBL9899738 0.64 IDO1 (0.53) MAPTIDO1KDM4E
SCHEMBL23959112 0.64 MAPT (0.50) MAPTCYP1A2MAPK1TP53POLB
SCHEMBL21067503 0.63 TP53 (0.47) MAPTCYP1A2MAPK1TP53POLB
SCHEMBL31219834 0.62 PGR (0.45) MAPTTP53POLBNQO2LMNA

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-20130012572-A1 Compositions And Methods For Inhibiting Expression Of GSK-3 Genes BANK OF AMERICA, N.A. 2013-01-10 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-20130012572-A1 Compositions And Methods For Inhibiting Expression Of GSK-3 Genes GSK3A, GSK3B, GSKIP MAPT 1963/4885CYP1A2 4789/4885MAPK1 3069/4885

“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.