SCHEMBL1879618

SCHEMBL1879618

CCS(=O)(=O)Nc1cccc(C(C)=O)c1

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.71
SMN1; SMN2 Q16637 2/20 0.71
HTT P42858 1/20 0.65
FKBP1A P62942 1/20 0.57
HPGD P15428 5/20 0.55
LMNA P02545 2/20 0.55
KMT2A Q03164 5/20 0.54
MEN1 O00255 4/20 0.54
TDP1 Q9NUW8 1/20 0.53
MAPT P10636 3/20 0.51
RAB9A P51151 1/20 0.51
USP2 O75604 1/20 0.51
TP53 P04637 1/20 0.51
PKM P14618 1/20 0.51
TSHR P16473 1/20 0.51
MAPK1 P28482 1/20 0.51
MCL1 Q07820 1/20 0.51
NOX1 Q9Y5S8 1/20 0.51

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
SCHEMBL1876467 0.89 ALDH1A1 (0.65) ALDH1A1SMN1; SMN2HTTFKBP1AHPGD
SCHEMBL4191220 0.87 LMNA (0.59) ALDH1A1SMN1; SMN2HPGDLMNAKMT2A
SCHEMBL29951376 0.86 ALDH1A1 (0.65) ALDH1A1SMN1; SMN2HTTFKBP1AHPGD
SCHEMBL11396218 0.84 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2HTTFKBP1AHPGD
SCHEMBL25110737 0.84 HPGD (0.53) ALDH1A1SMN1; SMN2HTTHPGDLMNA
SCHEMBL4187307 0.84 POLB (0.72) ALDH1A1SMN1; SMN2HPGDLMNAMAPT
SCHEMBL29953037 0.83 ALDH1A1 (0.61) ALDH1A1SMN1; SMN2HTTFKBP1AHPGD
SCHEMBL334530 0.83 ALDH1A1 (1.00) ALDH1A1SMN1; SMN2HTTFKBP1AHPGD
SCHEMBL4823240 0.81 HPGD (0.68) ALDH1A1SMN1; SMN2HPGDLMNAKMT2A
SCHEMBL30872952 0.80 ALDH1A1 (0.71) ALDH1A1SMN1; SMN2HTTFKBP1AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7947688-B2 N-[3-(3-substituted-pyrazolo[1,5-a]pyrimidin-7-yl)phenyl]-sulfonamides, and compositions, and methods related thereto FERRER INTERNACIONAL, S.A. (ES) 2011-05-24 US disclosed
EP-1648897-B1 N- [3-(3-SUBSTITUTED-PYRAZOLO[1,5-A] PYRIMIDIN-7-YL) PHENYL]-SULFONAMIDES, AND COMPOSITIONS, AND METHODS RELATED THERETO FERRER INT (ES) 2008-12-10 EP disclosed
CN-100393721-C N-[3-(3-substituted-pyrazolo[1,5-a]pyrimidin-7-yl)phenyl]-sulfonamides, and compositions, and methods related thereto FERRER INT (ES) 2008-06-11 CN disclosed
US-20060270690-A1 N-[3-(3-substituted-pyrazolo[1,5-a]pyrimidin-7-yl)phenyl]-sulfonamides, and compositions, and methods related thereto FERRER INTERNACIONAL S.A. (ES) 2006-11-30 US disclosed
CN-1829719-A N- [ 3- (3-substituted-pyrazolo [1, 5-a ] pyrimidin-7-yl) phenyl ] -sulfonamides, compositions thereof, and related methods FERRER INT (ES) 2006-09-06 CN disclosed
EP-1648897-A1 N- [3-(3-SUBSTITUTED-PYRAZOLO[1,5-A] PYRIMIDIN-7-YL) PHENYL]-SULFONAMIDES, AND COMPOSITIONS, AND METHODS RELATED THERETO FERRER INTERNACIONAL, S.A. (ES) 2006-04-26 EP disclosed
WO-2005014597-A1 N-[3-(3-SUBSTITUTED-PYRAZOLO[1,5-a]PYRIMIDIN-7-YL)PHENYL]-SULFONAMIDES, AND COMPOSITIONS, AND METHODS RELATED THERETO FERRER INTERNACIONAL, S.A. (ES) 2005-02-17 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-20060270690-A1 N-[3-(3-substituted-pyrazolo[1,5-a]pyrimidin-7-yl)phenyl]-sulfonamides, and compositions, and methods related thereto GABRA2, GABRA1, GABRA3 ALDH1A1 277/4885SMN1; SMN2 896/4885HTT 3306/4885

“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.