SCHEMBL6701630

SCHEMBL6701630

CCCCNC(=O)C1OC(=O)C=C1c1cccc2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.41
ALOX15 P16050 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPT P10636 1/20 0.41
NCEH1 Q6PIU2 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
ALDH1A1 P00352 3/20 0.38
MEN1 O00255 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
EPHX1 P07099 1/20 0.38
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
ASAH1 Q13510 1/20 0.37
GAA P10253 1/20 0.37
RECQL P46063 1/20 0.37
KDM4E B2RXH2 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
SCHEMBL6700774 0.81 HPGD (0.46) HPGDALOX15KMT2AMAPTALDH1A1
SCHEMBL6700580 0.79 HPGD (0.44) HPGDALOX15KMT2AMAPTALDH1A1
SCHEMBL6703334 0.79 PPARG (0.38) ALOX15KMT2AMAPTCYP2C19ALDH1A1
SCHEMBL6704728 0.75 EPHX1 (0.48) HPGDKMT2AALDH1A1MEN1L3MBTL1
SCHEMBL6703375 0.74 TP53 (0.43) HPGDKMT2AMAPTALDH1A1MEN1
SCHEMBL27792176 0.70 HTT (0.65) HPGDALOX15NCEH1L3MBTL1TSHR
SCHEMBL3750037 0.66 KCNA5 (0.56) ALDH1A1GAA
SCHEMBL30553831 0.66 HPGD (0.51) HPGDALOX15NCEH1CYP1A2CYP3A4
SCHEMBL20772779 0.66 HPGD (0.51) HPGDALOX15NCEH1CYP1A2CYP3A4
SCHEMBL1093718 0.66 TSHR (0.73) HPGDKMT2AMEN1L3MBTL1TSHR

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 HPGD 981/4885ALOX15 1518/4885KMT2A 3752/4885

“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.