SCHEMBL6705267

SCHEMBL6705267

CC(C)(C)NC(=O)c1cc(C(C)(C)C)cc(=O)o1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.40
MAOA P21397 2/20 0.39
MAOB P27338 2/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 3/20 0.36
KDM4E B2RXH2 2/20 0.36
POLB P06746 1/20 0.35
APEX1 P27695 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.35
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
HDAC1 Q13547 1/20 0.33

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
SCHEMBL12867819 0.77 MAOA (0.44) MAPTMAOAMAOBNPC1RAB9A
SCHEMBL6704193 0.75 NPC1 (0.47) MAPTMAOAMAOBNPC1RAB9A
SCHEMBL6703548 0.74 NPC1 (0.46) MAPTMAOAMAOBNPC1RAB9A
SCHEMBL12867881 0.73 MAOA (0.39) MAOAMAOBKMT2APOLBAPEX1
SCHEMBL6703223 0.73 ALDH1A1 (0.40) MAPTMAOAMAOBNPC1RAB9A
SCHEMBL6703029 0.71 MAOA (0.39) MAPTMAOAMAOBNPC1RAB9A
SCHEMBL6700660 0.70 MAOA (0.46) MAOAMAOBNPC1RAB9AKMT2A
SCHEMBL21028343 0.69 LMNA (0.42) KMT2AMEN1ALDH1A1LMNAHDAC1
SCHEMBL7217618 0.68 NR5A2 (0.44) KMT2AKDM4EPOLBAPEX1MEN1
SCHEMBL6703053 0.68 PGR (0.43) MAOAMAOB

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 MAPT 2509/4885MAOA 3783/4885MAOB 3533/4885

“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.