SCHEMBL508615

SCHEMBL508615

CCOCOc1c(C)nn(C)c(=O)c1-c1c(CC)cc(C)cc1CC

nearest known ligand 0.30

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.30
CDK8 P49336 1/20 0.30
ACVR1 Q04771 1/20 0.30
NPBWR1 P48145 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30

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
SCHEMBL10288488 0.91 LMNA (0.32) MAPTCDK8ACVR1NPBWR1LMNA
SCHEMBL15063888 0.85 KMT2A (0.32) MAPTCDK8ACVR1LMNA
SCHEMBL469902 0.84 CRHR1 (0.34) MAPTCDK8ACVR1LMNATP53
SCHEMBL509911 0.84
SCHEMBL15341167 0.78 GRM5 (0.41) NPBWR1TP53
SCHEMBL15086636 0.78 CDK8 (0.36) MAPTCDK8ACVR1LMNATP53
SCHEMBL469880 0.78 HPGD (0.41) CDK8ACVR1NPBWR1
SCHEMBL15341136 0.78 NPBWR1 (0.31) NPBWR1
SCHEMBL12481451 0.77
SCHEMBL510389 0.77 MAPT (0.32) MAPTCDK8ACVR1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8507410-B2 Pyridazinone compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-08-13 US disclosed
US-20120028803-A1 PYRIDAZINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-02-02 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-20120028803-A1 PYRIDAZINONE COMPOUND AND USE THEREOF C5, C1S, WEE1 MAPT 4297/4885CDK8 1594/4885ACVR1 1527/4885

“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.