SCHEMBL6788929

SCHEMBL6788929

CCOC(=O)c1[nH]nc2c1CCc1cc(O)ccc1-2

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
HSD17B10 Q99714 3/20 0.54
KDM4E B2RXH2 2/20 0.54
ALPL P05186 1/20 0.54
CLK1 P49759 1/20 0.54
AURKA O14965 1/20 0.54
MAPK10 P53779 1/20 0.54
RIPK1 Q13546 1/20 0.54
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
ATM Q13315 1/20 0.51
CYP2C8 P10632 1/20 0.46
CYP2C9 P11712 1/20 0.46
HCAR2 Q8TDS4 1/20 0.46
CDC25B P30305 1/20 0.41
ALDH1A1 P00352 4/20 0.41
GAA P10253 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 2/20 0.41

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
SCHEMBL6787022 0.91 AURKA (0.54) MEN1KMT2AHSD17B10KDM4EALPL
SCHEMBL6791498 0.87 MEN1 (0.60) MEN1KMT2AHSD17B10KDM4EALPL
SCHEMBL6793346 0.86 MEN1 (0.73) MEN1KMT2AHSD17B10KDM4EALPL
SCHEMBL6790482 0.85 MEN1 (0.54) MEN1KMT2AHSD17B10KDM4EALPL
SCHEMBL6791513 0.84 RAB9A (0.49) MEN1KMT2AHSD17B10KDM4EALPL
SCHEMBL6795341 0.81 KMT2A (0.51) MEN1KMT2AHSD17B10KDM4EALPL
SCHEMBL6794908 0.81 AURKA (0.54) MEN1KMT2AHSD17B10KDM4EALPL
SCHEMBL6795109 0.81 MEN1 (0.69) MEN1KMT2AHSD17B10KDM4EALPL
SCHEMBL6793552 0.80 CCNA2 (0.54) MEN1KMT2AHSD17B10KDM4EALPL
SCHEMBL6787187 0.80 MEN1 (0.54) MEN1KMT2AHSD17B10KDM4EALPL

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-20040127492-A1 Cyclic pyrazoles for the inhibition of mitogen activated protein kinase-activated protein kinase-2 PHARMACIA CORPORATION 2004-07-01 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-20040127492-A1 Cyclic pyrazoles for the inhibition of mitogen activated protein kinase-activated protein kinase-2 MKNK2, MAPKAPK2, MAP3K2 MEN1 1382/4885KMT2A 1257/4885HSD17B10 2776/4885

“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.