SCHEMBL4256867

SCHEMBL4256867

CC(C)(C(=O)O)N1CCOCC1.[NaH]

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
SMN1; SMN2 Q16637 5/20 0.45
TSHR P16473 2/20 0.45
MAPK1 P28482 1/20 0.45
USP2 O75604 1/20 0.42
HSD17B10 Q99714 1/20 0.39
MAPT P10636 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA9 Q16790 1/20 0.37
GLA P06280 1/20 0.36
MEN1 O00255 1/20 0.35
TP53 P04637 1/20 0.35
KMT2A Q03164 1/20 0.35
HTT P42858 1/20 0.35
CYP3A4 P08684 1/20 0.35
HIF1A Q16665 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
SCHEMBL1706642 0.98 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2TSHRMAPK1USP2
Hydrochloric Acid SCHEMBL25407374 0.95 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2TSHRMAPK1USP2
SCHEMBL11546415 0.82 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2TSHRMAPK1USP2
SCHEMBL7159906 0.80
SCHEMBL14549470 0.80 ALDH1A1 (0.42) ALDH1A1TSHRTP53HIF1A
SCHEMBL12928715 0.79 SMN1; SMN2 (0.48) ALDH1A1SMN1; SMN2TSHRMAPK1USP2
SCHEMBL22360354 0.77 SMN1; SMN2 (0.45) ALDH1A1SMN1; SMN2TSHRMAPK1USP2
SCHEMBL31302979 0.77 SMN1; SMN2 (0.45) ALDH1A1SMN1; SMN2TSHRMAPK1USP2
SCHEMBL2862694 0.77 SMN1; SMN2 (0.45) ALDH1A1SMN1; SMN2TSHRMAPK1USP2
4-Chloroaniline SCHEMBL10577680 0.77 PHGDH (0.45) ALDH1A1SMN1; SMN2TSHRMAPK1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090005355-A1 Piperidine Compound and Process for Preparing the Same TANABE SEIYAKU CO., LTD. (JP) 2009-01-01 US disclosed
EP-1765780-A1 PIPERIDINE COMPOUND AND PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 2007-03-28 EP disclosed
WO-2006004195-A1 PIPERIDINE COMPOUND AND PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 2006-01-12 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-20090005355-A1 Piperidine Compound and Process for Preparing the Same AVPR1B, HRH4, PRLHR ALDH1A1 2868/4885SMN1; SMN2 4150/4885TSHR 71/4885

“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.