SCHEMBL5009752

SCHEMBL5009752

COCC(=O)Nc1ccc(C(=O)O)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.68
MAPT P10636 2/20 0.68
ALOX12 P18054 1/20 0.68
MAPK1 P28482 1/20 0.68
HTT P42858 1/20 0.68
ALDH1A1 P00352 4/20 0.67
RAB9A P51151 2/20 0.67
SMN1; SMN2 Q16637 2/20 0.63
KDM4C Q9H3R0 2/20 0.60
STAT3 P40763 1/20 0.58
CYP2C19 P33261 1/20 0.58
NPC1 O15118 1/20 0.57
CSNK2A2 P19784 1/20 0.57
CSNK2A1 P68400 1/20 0.57
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
LMNA P02545 1/20 0.53
KDM5A P29375 1/20 0.53
KDM4D Q6B0I6 1/20 0.53
KDM5B Q9UGL1 1/20 0.53

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
SCHEMBL14962804 0.89 HPGD (0.81) HPGDMAPTALOX12MAPK1HTT
SCHEMBL5008292 0.86 MEN1 (0.77) HPGDMAPTALOX12MAPK1HTT
SCHEMBL588524 0.83 HPGD (0.86) HPGDMAPTALOX12MAPK1HTT
SCHEMBL9493864 0.82 MEN1 (0.63) HPGDMAPTALOX12MAPK1HTT
SCHEMBL18204569 0.82 STAT3 (0.55) HPGDMAPTALOX12MAPK1HTT
SCHEMBL22854085 0.81 HPGD (0.71) HPGDMAPTALOX12MAPK1HTT
SCHEMBL764569 0.81 HPGD (0.71) HPGDMAPTALOX12MAPK1HTT
SCHEMBL1976948 0.81 HPGD (0.71) HPGDMAPTALOX12MAPK1HTT
SCHEMBL9911435 0.81 STAT3 (0.55) HPGDMAPTALOX12MAPK1HTT
SCHEMBL5422115 0.81 MAPT (0.74) HPGDMAPTMAPK1HTTALDH1A1

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
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-4001218-A BACTERICIDES BAYER AKTIENGESELLSCHAFT (DT) 1977-01-04 US disclosed
US-3982011-A ANTIBIOTICS, ANIMAL GROWTH PROMOTERS BAYER AKTIENGESELLSCHAFT (DT) 1976-09-21 US disclosed
US-3931153-A BACTERICIDE BAYER AKTIENGESELLSCHAFT (DT) 1976-01-06 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 HPGD 3765/4885MAPT 4621/4885ALOX12 3691/4885

“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.