SCHEMBL4928353

SCHEMBL4928353

C=CCN(C(=O)OC(C)(C)C)S(C)(=O)=O

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA14 Q9ULX7 2/20 0.34
CA2 P00918 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HDAC6 Q9UBN7 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
CA7 P43166 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
RAB9A P51151 2/20 0.31

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
SCHEMBL16709497 0.85 CA12 (0.33) CA12CA1CA14CA2NPSR1
SCHEMBL16696945 0.81 RAB9A (0.41) CA12CA1CA14CA2NPSR1
SCHEMBL20236907 0.80 CA14 (0.36) CA12CA1CA14CA2NPSR1
SCHEMBL16697745 0.79 MEN1 (0.31) CA12CA1CA14CA2NPSR1
SCHEMBL16706553 0.77 RAB9A (0.32) CA12CA1CA14CA2NPSR1
SCHEMBL16472071 0.77 CA14 (0.36) CA12CA1CA14CA2HDAC6
SCHEMBL16697006 0.76 MEN1 (0.33) CA12CA1CA14CA2NPSR1
SCHEMBL956549 0.76 ALDH1A1 (0.42) CA14NPSR1HDAC6L3MBTL1SMN1; SMN2
SCHEMBL2622073 0.76 HDAC6 (0.38) CA14HDAC6L3MBTL1MEN1KMT2A
SCHEMBL5708145 0.75 C5AR1 (0.49) NPSR1MEN1KMT2ASMN1; SMN2RAB9A

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-20080058365-A1 Fused heterocyclic compounds AMGEN INC. 2008-03-06 US disclosed
US-7253179-B2 Fused heterocyclic compounds AMGEN INC. (US) 2007-08-07 US disclosed
EP-1562943-A1 FUSED HETEROCYCLIC COMPOUNDS Amgen Inc. (US) 2005-08-17 EP disclosed
US-20040147538-A1 Fused heterocyclic compounds AMGEN INC. 2004-07-29 US disclosed
WO-2004043958-A1 FUSED HETEROCYCLIC COMPOUNDS AMGEN INC. (US) 2004-05-27 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 (2 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-20080058365-A1 Fused heterocyclic compounds GIPR, MC4R, GPR119 CA12 3642/4885CA1 3170/4885CA14 3266/4885
US-20040147538-A1 Fused heterocyclic compounds GIPR, MC4R, GPR119 CA12 3642/4885CA1 3170/4885CA14 3266/4885

“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.