SCHEMBL6380414

SCHEMBL6380414

COc1cc(NC(C)=O)c(O)c2c1NC(=O)C2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
GAA P10253 1/20 0.37
GABRA1 P14867 2/20 0.37
GABRB2 P47870 2/20 0.37
ALDH1A1 P00352 3/20 0.36
ATM Q13315 1/20 0.36
TOP2A P11388 1/20 0.36
HSD17B1 P14061 1/20 0.36
HSD17B2 P37059 1/20 0.36
GABRA5 P31644 1/20 0.35
GABRA3 P34903 1/20 0.35
GABRA2 P47869 1/20 0.35
TSHR P16473 2/20 0.35
ABCC1 P33527 1/20 0.35
LMNA P02545 2/20 0.34
HTT P42858 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
HSD17B10 Q99714 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
SCHEMBL6383727 0.90 MEN1 (0.39) MEN1KMT2AGAAGABRA1GABRB2
SCHEMBL6382626 0.86 HTT (0.46) MEN1KMT2AALDH1A1TSHRHTT
SCHEMBL6387764 0.83 ROCK2 (0.37) MEN1KMT2AGAAALDH1A1LMNA
SCHEMBL6382108 0.80 MEN1 (0.38) MEN1KMT2AGAAGABRA1GABRB2
SCHEMBL6658731 0.79 DRD2 (0.35) MEN1KMT2AALDH1A1MAPTGSK3B
SCHEMBL6382649 0.76 HTT (0.44) KMT2AALDH1A1TSHRHTTKDM4E
SCHEMBL6384389 0.75 MEN1 (0.40) MEN1KMT2AGAAGABRA1GABRB2
SCHEMBL6380404 0.71 DHPS (0.43) GAAALDH1A1LMNAKDM4EMAPT
SCHEMBL6382724 0.71 ROCK2 (0.36) MEN1KMT2AGAAALDH1A1LMNA
SCHEMBL6382631 0.70 DRD2 (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050251927-A9 Dyeing composition comprising an acylaminophenol coupler and use of this coupler for dyeing keratinous fibres VIDAL LAURENT 2005-11-17 US claimed
US-20040205906-A1 Dyeing composition comprising an acylaminophenol coupler and use of this coupler for dyeing keratinous fibres L'OREAL S.A. (FR) 2004-10-21 US claimed
EP-1438949-A1 Composition for dyeing keratinous fibres comprising an acylaminophenol coupler L'OREAL (FR) 2004-07-21 EP claimed
US-20050251927-A9 Dyeing composition comprising an acylaminophenol coupler and use of this coupler for dyeing keratinous fibres VIDAL LAURENT 2005-11-17 US disclosed
US-20040205906-A1 Dyeing composition comprising an acylaminophenol coupler and use of this coupler for dyeing keratinous fibres L'OREAL S.A. (FR) 2004-10-21 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-20040205906-A1 Dyeing composition comprising an acylaminophenol coupler and use of this coupler for dyeing keratinous fibres KRT18, SLC25A20, ACR MEN1 3299/4885KMT2A 763/4885GAA 4683/4885
US-20050251927-A9 Dyeing composition comprising an acylaminophenol coupler and use of this coupler for dyeing keratinous fibres KRT18, SLC25A20, ACR MEN1 3299/4885KMT2A 763/4885GAA 4683/4885

“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.