SCHEMBL5111603

SCHEMBL5111603

COc1ccccc1-c1ccccc1NC(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.51
MAPT P10636 5/20 0.51
KMT2A Q03164 4/20 0.51
LMNA P02545 3/20 0.51
MEN1 O00255 3/20 0.51
KDM4E B2RXH2 3/20 0.51
HTT P42858 2/20 0.51
SMN1; SMN2 Q16637 3/20 0.50
MAPK1 P28482 2/20 0.49
GAA P10253 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
CLCN2 P51788 1/20 0.48
AKR1C3 P42330 1/20 0.48
AKR1C2 P52895 1/20 0.48
MCL1 Q07820 1/20 0.48
ATM Q13315 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
EGFR P00533 1/20 0.48
MMP1 P03956 1/20 0.48

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
SCHEMBL15861862 0.87 FABP3 (0.50) ALDH1A1MAPTKMT2ALMNAMEN1
SCHEMBL2093161 0.85 SMN1; SMN2 (0.65) ALDH1A1MAPTKMT2ALMNAMEN1
SCHEMBL4244901 0.85 MEN1 (0.52) ALDH1A1MAPTKMT2ALMNAMEN1
SCHEMBL6028756 0.82 MEN1 (0.55) ALDH1A1MAPTKMT2ALMNAMEN1
SCHEMBL6028723 0.81 MEN1 (0.55) ALDH1A1MAPTKMT2ALMNAMEN1
SCHEMBL4677801 0.81 LMNA (0.52) ALDH1A1MAPTKMT2ALMNAMEN1
SCHEMBL4681449 0.81 ALDH1A1 (0.53) ALDH1A1MAPTKMT2ALMNAMEN1
SCHEMBL7623806 0.80 PTGDR2 (0.45) ALDH1A1MAPTKMT2ALMNAMEN1
SCHEMBL2799331 0.80 SMN1; SMN2 (0.68) ALDH1A1KMT2AKDM4ESMN1; SMN2GAA
SCHEMBL15850343 0.79 MAPT (0.57) ALDH1A1MAPTKMT2ALMNAMEN1

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-20080249127-A1 Muscarinic Acetylcholine Receptor Antagonists LAINE DRAMANE I 2008-10-09 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-20080249127-A1 Muscarinic Acetylcholine Receptor Antagonists CHRM3, CHRNG, CHRM2 ALDH1A1 2948/4885MAPT 4036/4885KMT2A 2510/4885

“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.