SCHEMBL4945848

SCHEMBL4945848

Cc1cccc(Nc2ccccc2N)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.65
GAA P10253 4/20 0.65
TDP1 Q9NUW8 2/20 0.65
ALDH1A1 P00352 3/20 0.62
KDM4E B2RXH2 3/20 0.62
CYP1A2 P05177 3/20 0.62
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
CYP2D6 P10635 2/20 0.62
CYP2C9 P11712 2/20 0.62
CYP2C19 P33261 2/20 0.62
LMNA P02545 1/20 0.62
MAPK14 Q16539 5/20 0.60
MAPK13 O15264 3/20 0.60
MAPK12 P53778 3/20 0.60
MAPK11 Q15759 3/20 0.60
NPSR1 Q6W5P4 1/20 0.60
SMN1; SMN2 Q16637 2/20 0.58
RAB9A P51151 2/20 0.58
TP53 P04637 1/20 0.53

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
SCHEMBL1922073 0.86 NPSR1 (0.72) MAPTALDH1A1CYP1A2MEN1KMT2A
SCHEMBL7166997 0.86 MAPT (0.75) MAPTGAATDP1ALDH1A1KDM4E
SCHEMBL12786879 0.85 NPSR1 (0.55) MAPTGAATDP1ALDH1A1CYP1A2
SCHEMBL16767955 0.85 NPSR1 (0.55) MAPTGAATDP1ALDH1A1KDM4E
SCHEMBL28149600 0.85 ADORA2A (0.52) MAPTGAATDP1ALDH1A1KDM4E
SCHEMBL2944533 0.85 MAPT (0.69) MAPTGAATDP1ALDH1A1KDM4E
SCHEMBL9183066 0.85 MAPT (0.69) MAPTGAATDP1ALDH1A1KDM4E
SCHEMBL9185679 0.84 NPSR1 (0.58) MAPTGAATDP1ALDH1A1CYP1A2
SCHEMBL18045543 0.81 MAPT (0.62) MAPTGAATDP1ALDH1A1KDM4E
SCHEMBL7389020 0.81 MAPT (0.67) MAPTGAATDP1ALDH1A1KDM4E

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-20080161366-A1 AMINOALKYL SUBSTITUTED ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-07-03 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-20080161366-A1 AMINOALKYL SUBSTITUTED ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE SLC6A4, SLC6A2, SLC6A3 MAPT 97/4885GAA 525/4885TDP1 367/4885

“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.