SCHEMBL2055544

SCHEMBL2055544

CNC(=O)C1(C)CCS(=O)(=O)C1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.40
LMNA P02545 2/20 0.40
GAA P10253 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 2/20 0.35
TSHR P16473 1/20 0.35
CYP3A4 P08684 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KDM4E B2RXH2 2/20 0.33
FFAR3 O14843 1/20 0.31
CETP P11597 1/20 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
SCHEMBL21217470 0.78 CYP3A4 (0.33) CYP3A4SMN1; SMN2FFAR3
SCHEMBL11923803 0.76 POLB (0.40) POLBLMNAGAAL3MBTL1ALDH1A1
SCHEMBL2055538 0.76 FFAR3 (0.52) POLBLMNAGAAL3MBTL1ALDH1A1
SCHEMBL2055535 0.75 POLB (0.40) POLBLMNAGAAL3MBTL1ALDH1A1
SCHEMBL23199626 0.75 CETP (0.42) LMNAGAAALDH1A1CYP3A4SMN1; SMN2
SCHEMBL8567866 0.74
SCHEMBL2055548 0.74 POLB (0.39) POLBLMNAGAAL3MBTL1ALDH1A1
SCHEMBL8002686 0.73 CETP (0.44) LMNAGAAALDH1A1CYP3A4SMN1; SMN2
Hydrochloric Acid SCHEMBL27934607 0.71 CETP (0.43) LMNAGAAALDH1A1CYP3A4SMN1; SMN2
SCHEMBL2055546 0.71 LMNA (0.47) POLBLMNAGAAL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8921380-B2 Pyrazolo[1,5-a] pyrimidine compounds as CB1 receptor antagonist MITSUBISHI TANABE PHARMA CORPORATION (JP) 2014-12-30 US disclosed
US-20120202992-A1 PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AS CB1 RECEPTOR ANTAGONIST TANIMOTO KOICHI (JP) 2012-08-09 US disclosed
US-8163759-B2 Pyrazolo[1,5-A] pyrimidine compounds as CB1 receptor antagonist MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-04-24 US disclosed
US-20090258867-A1 PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AS CB1 RECEPTOR ANTAGONIST MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-10-15 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 (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-20120202992-A1 PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AS CB1 RECEPTOR ANTAGONIST CNR1, CNR2, CCKAR POLB 3296/4885LMNA 4794/4885GAA 4790/4885
US-20090258867-A1 PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AS CB1 RECEPTOR ANTAGONIST CNR1, CNR2, CCKAR POLB 3550/4885LMNA 4837/4885GAA 4741/4885

“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.