SCHEMBL1887929

SCHEMBL1887929

CC(N[C@](C)(Cc1ccccc1)C(=O)O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TACR3 P29371 3/20 0.52
ENPEP Q07075 2/20 0.45
CTSK P43235 3/20 0.45
APAF1 O14727 1/20 0.44
EPHX2 P34913 2/20 0.43
CTSL P07711 1/20 0.43
CTSS P25774 1/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
TRPA1 O75762 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
MAPT P10636 2/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HIF1A Q16665 1/20 0.42
OPRK1 P41145 1/20 0.41

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
SCHEMBL12637411 1.00 TACR3 (0.52) TACR3ENPEPCTSKAPAF1EPHX2
SCHEMBL23901642 0.85 ENPEP (0.48) TACR3ENPEPTRPA1MAPTALDH1A1
SCHEMBL12659224 0.80 SMN1; SMN2 (0.47) TACR3MEN1KMT2AMAPTALDH1A1
SCHEMBL12659236 0.80 SMN1; SMN2 (0.47) TACR3MEN1KMT2AMAPTALDH1A1
SCHEMBL12659222 0.80 SMN1; SMN2 (0.47) TACR3MEN1KMT2AMAPTALDH1A1
SCHEMBL12672526 0.80 BLM (0.46) TACR3APAF1MEN1KMT2AMAPT
SCHEMBL12659226 0.80 SMN1; SMN2 (0.47) TACR3MEN1KMT2AMAPTALDH1A1
SCHEMBL16103900 0.77 KMT2A (0.51) TACR3MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL1888549 0.77 KMT2A (0.51) TACR3MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL1888547 0.77 KMT2A (0.51) TACR3MEN1KMT2AALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2050738-B1 NOVEL IMIDAZOLIDINONE DERIVATIVE, METHOD OF PRODUCING THE SAME AND METHOD OF PRODUCING OPTICALLY ACTIVE AMINO ACID KANEKA CORP (JP) 2013-07-10 EP disclosed
US-7947722-B2 Imidazolidinone derivative, method of producing the same and method of producing optically active amino acid KANEKA CORPORATION (JP) 2011-05-24 US disclosed
US-20090209768-A1 NOVEL IMIDAZOLIDINONE DERIVATIVE, METHOD OF PRODUCING THE SAME AND METHOD OF PRODUCING OPTICALLY ACTIVE AMINO ACID KANEKA CORPORATION (JP) 2009-08-20 US disclosed
EP-2050738-A1 NOVEL IMIDAZOLIDINONE DERIVATIVE, METHOD OF PRODUCING THE SAME AND METHOD OF PRODUCING OPTICALLY ACTIVE AMINO ACID Kaneka Corporation (JP) 2009-04-22 EP 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-20090209768-A1 NOVEL IMIDAZOLIDINONE DERIVATIVE, METHOD OF PRODUCING THE SAME AND METHOD OF PRODUCING OPTICALLY ACTIVE AMINO ACID DAO, RCC2, AADAT TACR3 1446/4885ENPEP 243/4885CTSK 667/4885

“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.