SCHEMBL5002371

SCHEMBL5002371

O=C(O)CN1C(=O)COCC1=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.56
GAA P10253 2/20 0.56
POLB P06746 1/20 0.56
TSHR P16473 2/20 0.50
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
GSK3A P49840 1/20 0.46
GSK3B P49841 1/20 0.46
HTT P42858 2/20 0.45
ALDH1A1 P00352 2/20 0.42
KMO O15229 1/20 0.42
CA12 O43570 1/20 0.41
CA9 Q16790 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
HSD17B10 Q99714 2/20 0.39
KDM4E B2RXH2 1/20 0.35
CYP1A2 P05177 1/20 0.35
MAPT P10636 1/20 0.35
AKR1B1 P15121 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL14009883 0.80 POLB (0.55) SMN1; SMN2GAAPOLBTSHRKMT2A
SCHEMBL4600179 0.79 TSHR (0.52) SMN1; SMN2GAAPOLBTSHRKMT2A
SCHEMBL4143883 0.78 TSHR (0.50) SMN1; SMN2GAAPOLBTSHRKMT2A
SCHEMBL236431 0.78 TSHR (0.56) SMN1; SMN2GAATSHRKMT2AMEN1
SCHEMBL13263411 0.75 TSHR (0.48) SMN1; SMN2GAAPOLBTSHRKMT2A
SCHEMBL7776500 0.75 KMT2A (0.49) SMN1; SMN2GAAPOLBTSHRKMT2A
Ethylene Glycol SCHEMBL27986613 0.73 TSHR (0.50) SMN1; SMN2GAATSHRKMT2AMEN1
SCHEMBL4591492 0.71 HSD17B10 (0.47) SMN1; SMN2GAAPOLBTSHRKMT2A
SCHEMBL1467675 0.70 POLB (0.44) SMN1; SMN2GAAPOLBKMT2AMEN1
SCHEMBL9085834 0.70 TSHR (0.52) SMN1; SMN2GAAPOLBTSHRKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080275085-A1 Piperidine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-11-06 US 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-20080275085-A1 Piperidine derivative and use thereof TACR2, TACR1, PRLHR SMN1; SMN2 4526/4885GAA 4863/4885POLB 4766/4885

“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.