SCHEMBL3154117

SCHEMBL3154117

CCC(C)C(NS(C)(=O)=O)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.45
CA2 P00918 5/20 0.44
CA1 P00915 4/20 0.44
ENPEP Q07075 2/20 0.42
FPR2 P25090 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ATM Q13315 1/20 0.40
MME P08473 1/20 0.38
ACE P12821 1/20 0.38
CPA1 P15085 1/20 0.38
ACE2 Q9BYF1 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
SCHEMBL3154122 1.00 ALDH1A1 (0.52) ALDH1A1L3MBTL1CA2CA1ENPEP
SCHEMBL30356994 0.84 ALDH1A1 (0.52) ALDH1A1L3MBTL1CA2CA1ENPEP
SCHEMBL13335263 0.81 CA14 (0.48) ALDH1A1
SCHEMBL5839741 0.79 KDM4E (0.49)
SCHEMBL5839738 0.79 KDM4E (0.49)
SCHEMBL1432823 0.78 ALDH1A1 (0.50) ALDH1A1L3MBTL1CA2CA1ENPEP
SCHEMBL1432825 0.78 ALDH1A1 (0.50) ALDH1A1L3MBTL1CA2CA1ENPEP
SCHEMBL20906396 0.78 ALDH1A1 (0.46) ALDH1A1L3MBTL1CA2CA1ENPEP
SCHEMBL20906397 0.78 ALDH1A1 (0.46) ALDH1A1L3MBTL1CA2CA1ENPEP
SCHEMBL28005180 0.78 ALDH1A1 (0.46) ALDH1A1L3MBTL1CA2CA1ENPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100076015-A1 Aminopyridine Derivatives VANTIA LIMITED (GB) 2010-03-25 US disclosed
WO-2009133348-A1 AMINOPYRIDINE DERIVATIVES VANTIA LIMITED (GB) 2009-11-05 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-20100076015-A1 Aminopyridine Derivatives CHRM1, ARG1, ARG2 ALDH1A1 147/4885L3MBTL1 4240/4885CA2 897/4885

“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.