SCHEMBL6504137

SCHEMBL6504137

NC(=O)c1cn(C2CCCCC2)cn1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 4/20 0.47
CPB1 P15086 2/20 0.43
CDK5 Q00535 5/20 0.41
CDK5R1 Q15078 5/20 0.41
KDM5A P29375 3/20 0.39
WDR5 P61964 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
GSK3B P49841 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GAA P10253 1/20 0.36
ADA P00813 1/20 0.36

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
SCHEMBL30364250 0.93 KDM5A (0.43) CPB2CPB1CDK5CDK5R1KDM5A
SCHEMBL2327699 0.86 CPB2 (0.47) CPB2CPB1CDK5CDK5R1KDM5A
SCHEMBL17396261 0.85 CPB1 (0.45) CPB2CPB1KDM5AMEN1KMT2A
SCHEMBL2331925 0.84 CPB2 (0.45) CPB2CPB1CDK5CDK5R1KDM5A
SCHEMBL20497248 0.84 PIM1 (0.45) KMT2A
SCHEMBL20497250 0.84 PIM1 (0.45) KMT2A
SCHEMBL28070514 0.83 CPB2 (0.44) CPB2CPB1CDK5CDK5R1KDM5A
SCHEMBL20497273 0.82 CPB2 (0.38) CPB2CPB1CDK5CDK5R1KDM5A
SCHEMBL12985681 0.81 CDK5 (0.48) CPB2CPB1CDK5CDK5R1KDM5A
SCHEMBL20497264 0.80 KDM2B (0.52) CPB1WDR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220289720-A1 ARYL SULFONAMIDES AS SMALL MOLECULE STAT3 INHIBITORS UNIVERSITY OF HAWAII 2022-09-15 US disclosed
WO-2021016333-A1 ARYL SULFONAMIDES AS SMALL MOLECULE STAT3 INHIBITORS UNIVERSITY OF HAWAII (US) 2021-01-28 WO disclosed
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 (2 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-20220289720-A1 ARYL SULFONAMIDES AS SMALL MOLECULE STAT3 INHIBITORS STAT3, JAK2, STAT6 CPB2 3736/4885CPB1 3835/4885CDK5 793/4885
US-20050256167-A1 Preparation and use of imidazole derivatives for treatment of obesity GPR119, GIPR, PGC CPB2 4325/4885CPB1 3845/4885CDK5 1198/4885

“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.