SCHEMBL6062373

SCHEMBL6062373

C=CCC(CO)(NC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
CTSK P43235 8/20 0.33
CTSS P25774 5/20 0.33
KDM4E B2RXH2 1/20 0.32
CTSL P07711 1/20 0.31
CTSB P07858 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 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
SCHEMBL1730377 1.00 MAPT (0.38) MAPTTDP1SMN1; SMN2MEN1GAA
SCHEMBL23797497 0.88 MAPT (0.38) MAPTTDP1SMN1; SMN2MEN1GAA
SCHEMBL23797245 0.85 MAPT (0.39) MAPTTDP1SMN1; SMN2MEN1GAA
SCHEMBL8836642 0.85 TDP1 (0.42) TDP1MEN1GAAKMT2ACTSK
SCHEMBL1729943 0.84 MAPT (0.39) MAPTSMN1; SMN2MEN1GAAKMT2A
SCHEMBL6062712 0.84 MAPT (0.39) MAPTSMN1; SMN2MEN1GAAKMT2A
SCHEMBL5147739 0.80 CTSK (0.39) TDP1MEN1GAAKMT2ACTSK
SCHEMBL1728426 0.79 MAPT (0.34) MAPTSMN1; SMN2
SCHEMBL4399131 0.79 ALDH1A1 (0.47) MAPTCTSKCTSSCTSLCTSB
SCHEMBL6062681 0.79 MAPT (0.34) MAPTSMN1; SMN2

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-7008957-B2 Bicyclic cyanoheterocycles, process for their preparation and their use as medicaments SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2006-03-07 US disclosed
US-20050059716-A1 Novel bicyclic cyanoheterocycles, process for their preparation and their use as medicaments AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-03-17 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-20050059716-A1 Novel bicyclic cyanoheterocycles, process for their preparation and their use as medicaments CYP11B2, GOT2, CYP11B1 MAPT 4510/4885TDP1 4138/4885SMN1; SMN2 2086/4885

“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.