SCHEMBL13627837

SCHEMBL13627837

COC(=O)N1CCC(C(=O)NC[C@@H](C)O)CC1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.46
ALDH1A1 P00352 4/20 0.45
NPC1 O15118 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
TP53 P04637 1/20 0.45
ALOX15 P16050 1/20 0.45
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
RAB9A P51151 1/20 0.43
GAA P10253 3/20 0.40
EPHX2 P34913 1/20 0.40
MTNR1A P48039 3/20 0.39
MTNR1B P49286 3/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CYP2D6 P10635 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL13627846 1.00 HSD17B10 (0.46) HSD17B10ALDH1A1NPC1MEN1KMT2A
SCHEMBL10153992 0.79 SMN1; SMN2 (0.48) ALDH1A1NPC1MEN1KMT2AHTT
SCHEMBL13627843 0.78 LMNA (0.51) HSD17B10ALDH1A1NPC1HTTSMN1; SMN2
SCHEMBL2576718 0.78 MTNR1A (0.46) ALDH1A1NPC1MEN1KMT2ATP53
SCHEMBL2576721 0.78 MTNR1A (0.46) ALDH1A1NPC1MEN1KMT2ATP53
SCHEMBL1580316 0.77 HPGD (0.54) HSD17B10ALDH1A1NPC1KMT2AHTT
SCHEMBL13627848 0.76 CYP3A4 (0.50) HSD17B10ALDH1A1KMT2AHTTGAA
SCHEMBL13637441 0.76 CYP3A4 (0.50) HSD17B10ALDH1A1KMT2AHTTGAA
SCHEMBL5858399 0.75 EPHX1 (0.53) HSD17B10MEN1KMT2ASMN1; SMN2
SCHEMBL13637538 0.75 CYP3A4 (0.49) HSD17B10ALDH1A1KMT2AHTTGAA

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
US-7619092-B2 Piperidine compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-11-17 US disclosed
US-7619092-B2 Piperidine compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-11-17 US disclosed
US-20090198052-A1 METHOD FOR PREPARING OPTICALLY ACTIVE PIPERIDINE COMPOUNDS MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-08-06 US disclosed
US-20090198052-A1 METHOD FOR PREPARING OPTICALLY ACTIVE PIPERIDINE COMPOUNDS MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-08-06 US disclosed
EP-2022782-A1 PROCESS FOR PRODUCTION OF OPTICALLY ACTIVE PIPERIDINE COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2009-02-11 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-20090198052-A1 METHOD FOR PREPARING OPTICALLY ACTIVE PIPERIDINE COMPOUNDS SNCA, SYNJ1, KCNH2 HSD17B10 4429/4885ALDH1A1 2644/4885NPC1 2054/4885

“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.