SCHEMBL20819904

SCHEMBL20819904

C[C@@H]1CN[C@@H]([C@@H](O)c2ccccc2)C1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.41
EPHX1 P07099 1/20 0.36
CTSC P53634 1/20 0.36
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
LMNA P02545 2/20 0.34
HSD17B2 P37059 1/20 0.34
NR1I2 O75469 1/20 0.34
ABCB11 O95342 1/20 0.34
CARM1 Q86X55 1/20 0.33
PRMT6 Q96LA8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAN2A1 Q16706 1/20 0.33
MAN1B1 Q9UKM7 1/20 0.33

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
SCHEMBL20819850 1.00 GBA1 (0.41) GBA1EPHX1CTSCSLC6A2SLC6A4
SCHEMBL20819907 1.00 GBA1 (0.41) GBA1EPHX1CTSCSLC6A2SLC6A4
SCHEMBL20819950 1.00 GBA1 (0.41) GBA1EPHX1CTSCSLC6A2SLC6A4
SCHEMBL22371738 1.00 GBA1 (0.41) GBA1EPHX1CTSCSLC6A2SLC6A4
SCHEMBL20819949 1.00 GBA1 (0.41) GBA1EPHX1CTSCSLC6A2SLC6A4
SCHEMBL20819970 1.00 GBA1 (0.41) GBA1EPHX1CTSCSLC6A2SLC6A4
SCHEMBL20819969 1.00 GBA1 (0.41) GBA1EPHX1CTSCSLC6A2SLC6A4
SCHEMBL20819905 1.00 GBA1 (0.41) GBA1EPHX1CTSCSLC6A2SLC6A4
SCHEMBL20819962 0.83 SLC6A3 (0.42) SLC6A2SLC6A4SLC6A3LMNA
SCHEMBL9092486 0.81 GBA1 (0.46) GBA1EPHX1MAN2A1MAN1B1

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
US-11427539-B2 Beta-hydroxy heterocyclic amines and their use in the treatment of hyperglycaemia ATROGI AB (SE) 2022-08-30 US disclosed
US-20200277259-A1 BETA-HYDROXY HETEROCYCLIC AMINES AND THEIR USE IN THE TREATMENT OF HYPERGLYCAEMIA ATROGI AB (SE) 2020-09-03 US disclosed
EP-3681862-A1 BETA-HYDROXY HETEROCYCLIC AMINES AND THEIR USE IN THE TREATMENT OF HYPERGLYCAEMIA Atrogi AB (SE) 2020-07-22 EP disclosed
WO-2019053425-A1 BETA-HYDROXY HETEROCYCLIC AMINES AND THEIR USE IN THE TREATMENT OF HYPERGLYCAEMIA ATROGI AB (SE) 2019-03-21 WO 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-20200277259-A1 BETA-HYDROXY HETEROCYCLIC AMINES AND THEIR USE IN THE TREATMENT OF HYPERGLYCAEMIA SLC5A1, GPR119, SLC5A2 GBA1 695/4885EPHX1 828/4885CTSC 2088/4885
US-11427539-B2 Beta-hydroxy heterocyclic amines and their use in the treatment of hyperglycaemia SLC5A1, GPR119, SLC5A2 GBA1 695/4885EPHX1 828/4885CTSC 2088/4885

“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.