SCHEMBL1345646

SCHEMBL1345646

Cc1cccn(CCCC(C)C)c1=O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.41
ALDH1A1 P00352 1/20 0.40
GRM2 Q14416 6/20 0.39
DRD2 P14416 1/20 0.38
DRD3 P35462 1/20 0.38
MMP8 P22894 4/20 0.36
MMP14 P50281 4/20 0.36
MMP13 P45452 1/20 0.36
MAPT P10636 1/20 0.36
MMP17 Q9ULZ9 2/20 0.34
CNOT7 Q9UIV1 1/20 0.34
PSMB5 P28074 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 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
SCHEMBL9609772 0.90 GRM2 (0.47) PKMALDH1A1GRM2
SCHEMBL29161590 0.87 PKM (0.40) PKMALDH1A1GRM2DRD2DRD3
SCHEMBL22824347 0.81 CNR2 (0.46) PKMALDH1A1GRM2DRD2DRD3
SCHEMBL15118488 0.79 PKM (0.43) PKMALDH1A1DRD2DRD3MMP8
SCHEMBL13432029 0.79 PKM (0.47) PKMDRD2DRD3MMP8MMP14
SCHEMBL17618306 0.79 ALDH1A1 (0.33) ALDH1A1GRM2MAPT
SCHEMBL1345895 0.79 PKM (0.40) PKMALDH1A1GRM2DRD2DRD3
Hydrochloric Acid SCHEMBL3389277 0.78 PKM (0.46) PKMDRD2DRD3MMP8MMP14
SCHEMBL1130229 0.78 PKM (0.46) PKMDRD2DRD3MMP8MMP14
SCHEMBL29161579 0.78 PKM (0.42) PKMDRD2DRD3MMP8MMP14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8063055-B2 Substituted pyridone compounds and methods of use AMGEN INC. (US) 2011-11-22 US disclosed
US-20100160312-A1 Substituted Pyridone Compounds and Methods of Use AMGEN INC. (US) 2010-06-24 US disclosed
US-7700607-B2 Substituted pyridone compounds and methods of use AMGEN INC. 2010-04-20 US disclosed
US-20080249090-A1 Substituted pyridone compounds and methods of use AMGEN INC. (US) 2008-10-09 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-20100160312-A1 Substituted Pyridone Compounds and Methods of Use KIT, CMA1, C3AR1 PKM 703/4885ALDH1A1 491/4885GRM2 3658/4885
US-20080249090-A1 Substituted pyridone compounds and methods of use KIT, CMA1, C3AR1 PKM 703/4885ALDH1A1 491/4885GRM2 3658/4885

“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.