SCHEMBL1312359

SCHEMBL1312359

CC(C)(C)OC(=O)N1CCC[C@@H](O)[C@H]1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.47
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
LMNA P02545 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HPGD P15428 1/20 0.40
PREP P48147 2/20 0.40
UCHL1 P09936 1/20 0.39
EPHX1 P07099 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL1312360 1.00 HSD17B10 (0.53) HSD17B10SMN1; SMN2NPC1ALDH1A1CHRM2
SCHEMBL1312361 1.00 HSD17B10 (0.53) HSD17B10SMN1; SMN2NPC1ALDH1A1CHRM2
SCHEMBL2024759 0.92 HSD17B10 (0.47) HSD17B10SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL694279 0.92 HSD17B10 (0.47) HSD17B10SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL694281 0.92 HSD17B10 (0.47) HSD17B10SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL201852 0.92 HSD17B10 (0.47) HSD17B10SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL199927 0.92 HSD17B10 (0.47) HSD17B10SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL5579709 0.92 HSD17B10 (0.47) HSD17B10SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL694280 0.92 HSD17B10 (0.47) HSD17B10SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL375241 0.92 HSD17B10 (0.47) HSD17B10SMN1; SMN2CHRM2CHRM1CHRM3

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
CN-112851568-B Synthetic method of 3-hydroxy-2-piperidinecarboxylic acid compound and hydrochloride thereof 五邑大学 2022-06-24 CN disclosed
CN-112851568-A Synthetic method of 3-hydroxy-2-piperidinecarboxylic acid compound and hydrochloride thereof 五邑大学 2021-05-28 CN disclosed
WO-2016056031-A1 NOVEL DIOL COMPOUNDS SYNTHESIS AND ITS USE FOR FORMAL SYNTHESIS OF (2R, 3 S)-3-HYDROXYPIPECOLIC ACID COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2016-04-14 WO disclosed
US-20110275673-A1 INHIBITORS OF SPHINGOSINE KINASE 1 GENZYME CORPORATION 2011-11-10 US disclosed
WO-2010033701-A2 INHIBITORS OF SPHINGOSINE KINASE 1 GENZYME CORPORATION (US) 2010-03-25 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 (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-20110275673-A1 INHIBITORS OF SPHINGOSINE KINASE 1 SPHK1, SPHK2, S1PR1 HSD17B10 914/4885SMN1; SMN2 1693/4885NPC1 137/4885

“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.