SCHEMBL14513315

SCHEMBL14513315

CCC(=O)N1CC[C@H](CO)[C@@H]1CO

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 2/20 0.34
▸ CHRNA3 P32297 2/20 0.34
▸ CHRNA4 P43681 2/20 0.34
▸ CHRNB4 P30926 1/20 0.34
▸ CHRNA7 P36544 1/20 0.34
▸ TSHR P16473 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ EPHX2 P34913 2/20 0.33
▸ POLB P06746 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ GBA1 P04062 1/20 0.32
▸ HCRTR2 O43614 1/20 0.32
▸ CHRNB3 Q05901 1/20 0.32
▸ CHRNA6 Q15825 1/20 0.32
▸ MAPT P10636 1/20 0.31
▸ DPP4 P27487 2/20 0.30
▸ GBA2 Q9HCG7 2/20 0.30

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
SCHEMBL13032050 0.81 GBA1 (0.42) TSHRMEN1HTTKMT2AEPHX2
SCHEMBL16187759 0.81 DPP4 (0.42) POLBL3MBTL1DPP4
SCHEMBL13032048 0.72 MEN1 (0.35) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL13032108 0.72 MEN1 (0.35) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL20470740 0.70 — —
SCHEMBL16246609 0.69 DPP4 (0.35) POLBGBA1MAPTDPP4GBA2
SCHEMBL28000005 0.69 DPP4 (0.36) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL116501 0.68 NR1H2 (0.41) MEN1KMT2AL3MBTL1
SCHEMBL12156743 0.68 POLB (0.66) MEN1KMT2APOLBL3MBTL1DPP4
SCHEMBL10272735 0.68 POLB (0.66) MEN1KMT2APOLBL3MBTL1DPP4

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-20070105803-A1 Methods and compositions for treating neurological disease MASSACHUSETTS, UNIVERSITY OF 2007-05-10 — — 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-20070105803-A1 Methods and compositions for treating neurological disease SMN1; SMN2, CLN6, INA CHRNB2 127/4885CHRNA3 135/4885CHRNA4 233/4885

“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.

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