SCHEMBL4551353

SCHEMBL4551353

CCCCCS(=O)(=O)N1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CNR2 P34972 1/20 0.41
GPR119 Q8TDV5 3/20 0.41
TGM2 P21980 8/20 0.40
F13A1 P00488 6/20 0.40
TGM1 P22735 3/20 0.40
GAA P10253 2/20 0.39
TSHR P16473 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL7527689 0.99 USP2 (0.42) USP2SMN1; SMN2CNR2GPR119TGM2
SCHEMBL2253618 0.90 SMN1; SMN2 (0.46) USP2SMN1; SMN2TGM2F13A1TGM1
SCHEMBL6196618 0.87 USP2 (0.44) USP2SMN1; SMN2GPR119TGM2F13A1
SCHEMBL2249760 0.86 USP2 (0.51) USP2SMN1; SMN2TGM2F13A1TGM1
SCHEMBL960091 0.86 GPR119 (0.43) USP2SMN1; SMN2GPR119TGM2F13A1
SCHEMBL30183473 0.86 USP2 (0.43) USP2SMN1; SMN2GPR119TGM2F13A1
SCHEMBL5214356 0.86 USP2 (0.43) USP2SMN1; SMN2GPR119TGM2F13A1
SCHEMBL961058 0.83 TGM2 (0.43) USP2SMN1; SMN2GPR119TGM2F13A1
SCHEMBL26113743 0.82 USP2 (0.45) USP2SMN1; SMN2GPR119TGM2F13A1
Hydrochloric Acid SCHEMBL12501570 0.81 USP2 (0.44) USP2SMN1; SMN2GPR119TGM2F13A1

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-20090005375-A1 ACETYL COENZYME A CARBOXYLASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-01-01 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-20090005375-A1 ACETYL COENZYME A CARBOXYLASE INHIBITORS ACACA, ACACB, ACAT1 USP2 731/4885SMN1; SMN2 4276/4885CNR2 3069/4885

“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.