SCHEMBL5013422

SCHEMBL5013422

CCCCN(C(=O)c1cc(NC(=O)c2cc(F)c(F)cc2Cl)[nH]n1)C1CCN(C(=O)C(=O)OCC)CC1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.40
LMNA P02545 4/20 0.40
ALDH1A1 P00352 4/20 0.40
HTT P42858 2/20 0.39
RECQL P46063 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
GPR55 Q9Y2T6 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PTBP1 P26599 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36
UBE2M P61081 2/20 0.36
DCUN1D1 Q96GG9 2/20 0.36
DUSP3 P51452 1/20 0.35
PTPN5 P54829 1/20 0.35
PTPN11 Q06124 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL5013637 0.92 ALDH1A1 (0.39) SMN1; SMN2LMNAALDH1A1HTTRECQL
SCHEMBL5013420 0.90 ALDH1A1 (0.38) SMN1; SMN2LMNAALDH1A1HTTRECQL
SCHEMBL14587654 0.89 ALDH1A1 (0.47) SMN1; SMN2LMNAALDH1A1HTTRECQL
SCHEMBL14587657 0.87 UBE2M (0.38) SMN1; SMN2LMNAALDH1A1HTTRECQL
SCHEMBL5010446 0.87 MAPT (0.39) SMN1; SMN2LMNAALDH1A1HTTRECQL
SCHEMBL5009754 0.85 NPC1 (0.42) SMN1; SMN2ALDH1A1HTTRECQLKMT2A
SCHEMBL5008467 0.85 HTT (0.37) LMNAALDH1A1HTTRECQLKMT2A
SCHEMBL5010424 0.84 ENPP2 (0.42) SMN1; SMN2LMNAALDH1A1HTTRECQL
SCHEMBL5008205 0.84 HTT (0.41) SMN1; SMN2ALDH1A1HTTRECQLKMT2A
SCHEMBL5009775 0.83 HTT (0.40) SMN1; SMN2ALDH1A1HTTRECQLKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1884513-A1 PYRAZOLE COMPOUND AND THERAPEUTIC AGENT FOR DIABETES COMPRISING THE SAME Japan Tobacco, Inc. (JP) 2008-02-06 EP claimed
US-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents JAPAN TOBACCO INC. (JP) 2007-02-08 US claimed
EP-1884513-A1 PYRAZOLE COMPOUND AND THERAPEUTIC AGENT FOR DIABETES COMPRISING THE SAME Japan Tobacco, Inc. (JP) 2008-02-06 EP disclosed
US-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents JAPAN TOBACCO INC. (JP) 2007-02-08 US disclosed
US-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents JAPAN TOBACCO INC. (JP) 2007-02-08 US disclosed
US-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents JAPAN TOBACCO INC. (JP) 2007-02-08 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-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents PYGL, GYS2, AGL SMN1; SMN2 4705/4885LMNA 2123/4885ALDH1A1 1278/4885

“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.