SCHEMBL6500732

SCHEMBL6500732

CCc1[nH]cnc1C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.46
HSD17B10 Q99714 1/20 0.46
GDA Q9Y2T3 1/20 0.41
KDM4E B2RXH2 2/20 0.40
LMNA P02545 3/20 0.38
XDH P47989 3/20 0.38
CDC7 O00311 1/20 0.36
TSHR P16473 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
PAX8 Q06710 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MMP9 P14780 1/20 0.36
GAA P10253 3/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PARP1 P09874 1/20 0.35
HCAR2 Q8TDS4 2/20 0.34
GABRR1 P24046 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
SCHEMBL6499135 0.87 CYP2C19 (0.44) CYP2C19HSD17B10GDAKDM4ELMNA
SCHEMBL15782808 0.82 HSD17B10 (0.47) CYP2C19HSD17B10KDM4ELMNASMN1; SMN2
SCHEMBL16399189 0.82 CYP2C19 (0.47) CYP2C19HSD17B10GDAKDM4ELMNA
SCHEMBL16398756 0.81 CYP2C19 (0.46) CYP2C19HSD17B10GDAKDM4ELMNA
SCHEMBL23213731 0.78 KDM4E (0.45) CYP2C19HSD17B10KDM4ELMNATSHR
SCHEMBL10278987 0.77 KDM4E (0.59) HSD17B10KDM4ELMNASMN1; SMN2ALDH1A1
SCHEMBL7435782 0.77 CYP2C19 (0.42) CYP2C19HSD17B10GDALMNAXDH
SCHEMBL3025277 0.75
SCHEMBL4954812 0.74
Hydrochloric Acid SCHEMBL10712747 0.74 GDA (0.45) CYP2C19HSD17B10GDAKDM4ELMNA

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-20050256167-A1 Preparation and use of imidazole derivatives for treatment of obesity BAYER PHARMACEUTICALS CORPORATION (US) 2005-11-17 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-20050256167-A1 Preparation and use of imidazole derivatives for treatment of obesity GPR119, GIPR, PGC CYP2C19 195/4885HSD17B10 1809/4885GDA 2741/4885

“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.