SCHEMBL19007844

SCHEMBL19007844

CC(=N)N(C)C(=O)OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.58
MAPT P10636 1/20 0.49
HPGD P15428 1/20 0.49
TDP1 Q9NUW8 3/20 0.47
KMT2A Q03164 2/20 0.47
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
SIGMAR1 Q99720 1/20 0.45
ABCB1 P08183 1/20 0.45
LMNA P02545 2/20 0.44
HCAR2 Q8TDS4 1/20 0.44
CCR6 P51684 1/20 0.43
PAX8 Q06710 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL7694380 0.88 ALDH1A1 (0.62) ALDH1A1MAPTHPGDTDP1KMT2A
SCHEMBL27411794 0.85 ALDH1A1 (0.51) ALDH1A1MAPTHPGDTDP1KMT2A
SCHEMBL3254015 0.85 ALDH1A1 (0.51) ALDH1A1MAPTHPGDTDP1KMT2A
Hydrochloric Acid SCHEMBL3666065 0.84 ALDH1A1 (0.50) ALDH1A1MAPTHPGDTDP1KMT2A
SCHEMBL23964175 0.82 ALDH1A1 (0.61) ALDH1A1MAPTHPGDTDP1KMT2A
SCHEMBL20716127 0.81 ALDH1A1 (0.55) ALDH1A1MAPTHPGDTDP1KMT2A
SCHEMBL22283338 0.81 ALDH1A1 (0.55) ALDH1A1MAPTHPGDTDP1KMT2A
SCHEMBL3352839 0.81 ALDH1A1 (0.59) ALDH1A1MAPTHPGDTDP1KMT2A
Benzyl Dimethylcarbamate SCHEMBL5134244 0.80 ALDH1A1 (0.62) ALDH1A1MAPTHPGDTDP1KMT2A
Benzyl Dimethylcarbamate SCHEMBL14031385 0.80 ALDH1A1 (0.62) ALDH1A1MAPTHPGDTDP1KMT2A

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-20170174622-A1 METHOD FOR PRODUCING TRI-CARBOBENZOXY-ARGININE KANEKA CORPORATION (JP) 2017-06-22 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-20170174622-A1 METHOD FOR PRODUCING TRI-CARBOBENZOXY-ARGININE ARG1, ARGLU1, PRMT1 ALDH1A1 3308/4885MAPT 3623/4885HPGD 1201/4885

“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.