SCHEMBL23064151

SCHEMBL23064151

CN(C)[C@H](CCc1ccccc1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.49
ALDH1A1 P00352 2/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HPGD P15428 1/20 0.46
GRIK1 P39086 1/20 0.45
CNR2 P34972 1/20 0.45
ALOX5 P09917 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
SCHEMBL23064152 1.00 TSHR (0.49) TSHRALDH1A1MAPTKMT2AMEN1
SCHEMBL11838769 0.90 MMP12 (0.54) TSHRALDH1A1MAPTHTT
SCHEMBL10482476 0.86 AOC3 (0.47) TSHRALDH1A1KMT2AMEN1HTT
Hydrochloric Acid SCHEMBL8190926 0.84 ALDH1A1 (0.47) TSHRALDH1A1MAPTKMT2AMEN1
SCHEMBL6450579 0.83 TSHR (0.44) TSHRALDH1A1MAPTKMT2AMEN1
SCHEMBL5870453 0.82 TSHR (0.46) TSHRKMT2AMEN1HTTSMN1; SMN2
SCHEMBL21953013 0.82 SLC6A2 (0.50) ALDH1A1SMN1; SMN2
SCHEMBL8255779 0.82 TSHR (0.46) TSHRKMT2AMEN1HTTSMN1; SMN2
SCHEMBL3663595 0.81 PPARG (0.46) TSHRKMT2AMEN1HTTSMN1; SMN2
SCHEMBL121728 0.81 MAPT (0.61) ALDH1A1MAPTKMT2AMEN1HTT

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3788039-B1 FACTOR XIIA INHIBITORS UNIV LEEDS INNOVATIONS LTD (GB) 2026-02-11 EP disclosed
US-20210087172-A1 FACTOR XIIa INHIBITORS UNIVERSITY OF LEEDS (GB) 2021-03-25 US disclosed
US-20210087172-A1 FACTOR XIIa INHIBITORS UNIVERSITY OF LEEDS (GB) 2021-03-25 US disclosed
EP-3788039-A1 FACTOR XIIA INHIBITORS University of Leeds (GB) 2021-03-10 EP disclosed
CN-112204023-A Factor XIIa inhibitors 利兹大学 2021-01-08 CN 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-20210087172-A1 FACTOR XIIa INHIBITORS F11, F13B, F12 TSHR 2718/4885ALDH1A1 1427/4885MAPT 4616/4885

“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.