SCHEMBL4627329

SCHEMBL4627329

CC(C)c1ccn(-c2ccccc2)c(=O)c1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.55
DDB1 Q16531 1/20 0.43
CRBN Q96SW2 1/20 0.43
IDH1 O75874 1/20 0.43
COMT P21964 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP1A2 P05177 1/20 0.42
HPGD P15428 1/20 0.42
BLM P54132 1/20 0.42
HSD17B10 Q99714 1/20 0.42
NOTUM Q6P988 1/20 0.40
KCNH2 Q12809 1/20 0.39
MCHR1 Q99705 1/20 0.39

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
SCHEMBL889379 0.87 MGLL (0.48) SMN1; SMN2KDM4EALDH1A1NOTUM
SCHEMBL13575372 0.85 SMN1; SMN2 (0.55) SMN1; SMN2DDB1CRBNCOMTKDM4E
SCHEMBL12438375 0.84 F2 (0.44) SMN1; SMN2COMTKDM4EALDH1A1CYP1A2
SCHEMBL10140801 0.82 ALDH1A1 (0.38) SMN1; SMN2KDM4EALDH1A1HPGDKCNH2
SCHEMBL25016644 0.75 HDAC4 (0.43) SMN1; SMN2COMTKDM4EALDH1A1HPGD
SCHEMBL7861231 0.75 SMN1; SMN2 (0.60) SMN1; SMN2DDB1CRBNCOMTKDM4E
SCHEMBL10059763 0.74 ALDH1A1 (0.59) SMN1; SMN2DDB1CRBNIDH1COMT
SCHEMBL22185246 0.74 BIRC5 (0.41) SMN1; SMN2ALDH1A1NOTUM
SCHEMBL22185248 0.74 PLA2G4A (0.48) SMN1; SMN2ALDH1A1KCNH2
SCHEMBL10059829 0.73 SMN1; SMN2 (0.41) SMN1; SMN2DDB1CRBNNOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539155-B1 STABLE CREAM PREPARATIONS OF PHENYL-PYRIDONE COMPOUNDS FOR TOPICAL APPLICATION MEPHA AG (CH) 2008-04-02 EP claimed
US-20060039931-A1 Stable cream preparations of phenyl-pyridone compounds for topical application MEPHA AG (CH) 2006-02-23 US claimed
US-11279733-B2 Peptide antibiotics THE UNIVERSITY OF QUEENSLAND (AU) 2022-03-22 US disclosed
US-20200361994-A1 PEPTIDE ANTIBIOTICS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2020-11-19 US disclosed
EP-1539155-B1 STABLE CREAM PREPARATIONS OF PHENYL-PYRIDONE COMPOUNDS FOR TOPICAL APPLICATION MEPHA AG (CH) 2008-04-02 EP disclosed
US-20060039931-A1 Stable cream preparations of phenyl-pyridone compounds for topical application MEPHA AG (CH) 2006-02-23 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 (3 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-20060039931-A1 Stable cream preparations of phenyl-pyridone compounds for topical application PNPO, APOB, PLPBP SMN1; SMN2 2468/4885DDB1 1699/4885CRBN 4243/4885
US-20200361994-A1 PEPTIDE ANTIBIOTICS NGLY1, VIP, PEPD SMN1; SMN2 4207/4885DDB1 1201/4885CRBN 4103/4885
US-11279733-B2 Peptide antibiotics NGLY1, VIP, PEPD SMN1; SMN2 4207/4885DDB1 1201/4885CRBN 4103/4885

“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.