SCHEMBL23944892

SCHEMBL23944892

CN(C)N(C)C(=O)OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.58
MAPT P10636 1/20 0.53
HPGD P15428 1/20 0.53
TDP1 Q9NUW8 2/20 0.52
MAPK1 P28482 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
SLC6A2 P23975 1/20 0.52
SLC6A3 Q01959 1/20 0.52
KMT2A Q03164 1/20 0.52
SIGMAR1 Q99720 1/20 0.48
ABCB1 P08183 1/20 0.48
LMNA P02545 2/20 0.47
HCAR2 Q8TDS4 1/20 0.47
CTSL P07711 2/20 0.47
CTSB P07858 2/20 0.47
CTSS P25774 2/20 0.47
CTSK P43235 2/20 0.47
CCR6 P51684 1/20 0.47
PAX8 Q06710 1/20 0.47
NPC1 O15118 1/20 0.45

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
SCHEMBL7810375 0.86 ALDH1A1 (0.55) ALDH1A1MAPTHPGDTDP1MAPK1
Benzyl Dimethylcarbamate SCHEMBL14031385 0.85 ALDH1A1 (0.62) ALDH1A1MAPTHPGDTDP1MAPK1
SCHEMBL7694380 0.85 ALDH1A1 (0.62) ALDH1A1MAPTHPGDTDP1MAPK1
Benzyl Dimethylcarbamate SCHEMBL5134244 0.85 ALDH1A1 (0.62) ALDH1A1MAPTHPGDTDP1MAPK1
Benzyl Dimethylcarbamate SCHEMBL20401678 0.85 ALDH1A1 (0.62) ALDH1A1MAPTHPGDTDP1MAPK1
SCHEMBL250619 0.83 ALDH1A1 (0.60) ALDH1A1MAPTHPGDTDP1MAPK1
SCHEMBL3352839 0.82 ALDH1A1 (0.59) ALDH1A1MAPTHPGDTDP1MAPK1
SCHEMBL24968118 0.81 ALDH1A1 (0.58) ALDH1A1MAPTHPGDTDP1MAPK1
SCHEMBL8016043 0.81 ALDH1A1 (0.58) ALDH1A1MAPTHPGDTDP1MAPK1
SCHEMBL24115182 0.81 ALDH1A1 (0.58) ALDH1A1MAPTHPGDTDP1MAPK1

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-20210323913-A1 SIGMA RECEPTOR BINDERS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2021-10-21 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-20210323913-A1 SIGMA RECEPTOR BINDERS SIGMAR1, OPRK1, OPRL1 ALDH1A1 431/4885MAPT 373/4885HPGD 3786/4885

“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.