SCHEMBL6703029

SCHEMBL6703029

CC(C)(C)NC(=O)c1cc(-c2cccc(O)c2)cc(=O)o1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
LHCGR P22888 1/20 0.39
ANO1 Q5XXA6 1/20 0.38
HSD17B1 P14061 4/20 0.38
HSD17B2 P37059 4/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C9 P11712 2/20 0.38
MAPT P10636 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37
DHFR P00374 1/20 0.36
CYP1A2 P05177 1/20 0.36
KCNH2 Q12809 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
CYP2D6 P10635 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL6704193 0.86 NPC1 (0.47) MAOAMAOBCYP2C9MAPTNPC1
SCHEMBL6703548 0.85 NPC1 (0.46) MAOAMAOBCYP2C9MAPTNPC1
SCHEMBL6703053 0.83 PGR (0.43) MAOAMAOBANO1
SCHEMBL6700660 0.81 MAOA (0.46) MAOAMAOBANO1NPC1RAB9A
SCHEMBL6703223 0.78 ALDH1A1 (0.40) MAOAMAOBANO1MAPTNPC1
SCHEMBL13701677 0.76 KDM4E (0.50) ANO1HSD17B1HSD17B2CYP3A4CYP2C9
SCHEMBL6705267 0.71 MAPT (0.40) MAOAMAOBMAPTNPC1RAB9A
SCHEMBL159047 0.69 KDM4E (0.61) ANO1NPC1RAB9AALDH1A1LMNA
SCHEMBL12867819 0.68 MAOA (0.44) MAOAMAOBMAPTNPC1RAB9A
SCHEMBL13611923 0.66 EGFR (0.50) CYP2C9MAPTNPC1RAB9ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040102488-A1 Butenolide and pentenolide derivatives as kinase inhibitors MORPHOCHEM AG (DE) 2004-05-27 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-20040102488-A1 Butenolide and pentenolide derivatives as kinase inhibitors MAP3K20, MAP3K21, MAP3K1 MAOA 3783/4885MAOB 3533/4885LHCGR 1806/4885

“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.