SCHEMBL3342928

SCHEMBL3342928

NC(=O)C1Cc2[c]cccc2O1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SIRT1 Q96EB6 14/20 0.38
SIRT2 Q8IXJ6 8/20 0.36
NISCH Q9Y2I1 1/20 0.36
ATM Q13315 1/20 0.35
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
SIRT3 Q9NTG7 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
SCHEMBL29974170 0.72 HPGD (0.59) SIRT1SIRT2NISCHATMHPGD
SCHEMBL860446 0.72 HPGD (0.59) SIRT1SIRT2NISCHATMHPGD
SCHEMBL20482181 0.72 BRD4 (0.41) HPGD
SCHEMBL4592476 0.70 SMN1; SMN2 (0.36) ATMHPGD
SCHEMBL29499451 0.68 MAOB (0.56) SIRT1
SCHEMBL12561159 0.68 MAOB (0.56) SIRT1
SCHEMBL3877557 0.68 AOC2 (0.38) SIRT1SIRT2HPGDTSHR
SCHEMBL9520473 0.67 ATM (0.35) ATM
SCHEMBL5803067 0.66 GAA (0.39)
SCHEMBL2977327 0.65 NISCH (0.71) NISCHHPGD

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
EP-2393781-B1 DIHYDROPYRIDONE UREAS AS P2X7 MODULATORS HOFFMANN LA ROCHE (CH) 2014-03-12 EP disclosed
US-20100160388-A1 DIHYDROPYRIDONE UREAS AS P2X7 MODULATORS ROCHE PALO ALTO LLC 2010-06-24 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-20100160388-A1 DIHYDROPYRIDONE UREAS AS P2X7 MODULATORS P2RY1, P2RX1, P2RX3 SIRT1 401/4885SIRT2 902/4885NISCH 2967/4885

“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.