SCHEMBL10316494

SCHEMBL10316494

COCCN(CCOC)c1ccc([C@H](CO)NC(=O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR88 Q9GZN0 8/20 0.46
CNR2 P34972 5/20 0.39
ALDH1A1 P00352 2/20 0.38
TSHR P16473 1/20 0.38
RIPK1 Q13546 1/20 0.38
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
EGFR P00533 1/20 0.37
ERBB2 P04626 1/20 0.37
MEN1 O00255 1/20 0.37
TP53 P04637 1/20 0.37
KMT2A Q03164 1/20 0.37
TAS1R3 Q7RTX0 1/20 0.37
TAS1R1 Q7RTX1 1/20 0.37

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
SCHEMBL12801905 0.84 MAPT (0.40) GPR88CNR2ALDH1A1TSHRRIPK1
SCHEMBL10316495 0.81 ALDH1A1 (0.58) CNR2ALDH1A1TSHRRIPK1RAB9A
SCHEMBL1443324 0.77 CNR2 (0.40) CNR2ALDH1A1TSHRHPGDHTT
SCHEMBL6254108 0.75 GPR88 (0.68) GPR88CNR2MEN1KMT2ATAS1R3
SCHEMBL6256724 0.75 GPR88 (0.68) GPR88CNR2MEN1KMT2ATAS1R3
SCHEMBL23100736 0.75 GPR88 (0.68) GPR88CNR2MEN1KMT2ATAS1R3
SCHEMBL25295633 0.74 LMNA (0.51) GPR88CNR2ALDH1A1RIPK1MEN1
SCHEMBL25295634 0.74 LMNA (0.51) GPR88CNR2ALDH1A1RIPK1MEN1
SCHEMBL1443323 0.73 CNR2 (0.36) CNR2ALDH1A1TSHRHPGDHTT
SCHEMBL12801923 0.73 MAPT (0.40) CNR2ALDH1A1TSHRHPGDHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9650362-B2 Inhibitors PROBIODRUG AG (DE) 2017-05-16 US disclosed
US-20160039795-A1 NOVEL INHIBITORS VIVORYON THERAPEUTICS N.V. (DE) 2016-02-11 US disclosed
US-9173885-B2 Inhibitors PROBIODRUG AG (DE) 2015-11-03 US disclosed
EP-2475428-B1 HETEROCYLCIC DERIVATIVES AS INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2015-07-01 EP disclosed
US-20140065095-A1 NOVEL INHIBITORS VIVORYON THERAPEUTICS N.V. (DE) 2014-03-06 US disclosed
US-8486940-B2 Inhibitors PROBIODRUG AG (DE) 2013-07-16 US disclosed
EP-2475428-A1 HETEROCYLCIC DERIVATIVES AS INHIBITORS OF GLUTAMINYL CYCLASE Probiodrug AG (DE) 2012-07-18 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 (2 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-20160039795-A1 NOVEL INHIBITORS GLUL, QPCT, GLS GPR88 1678/4885CNR2 2749/4885ALDH1A1 2195/4885
US-20140065095-A1 NOVEL INHIBITORS GLUL, QPCT, GLS GPR88 1678/4885CNR2 2749/4885ALDH1A1 2195/4885

“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.