SCHEMBL6704676

SCHEMBL6704676

O=C1C=C(c2ccc(Cl)cc2)C(C(=O)NCc2ccccc2)O1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.46
MDM2 Q00987 4/20 0.46
SCN2A Q99250 1/20 0.46
SCN10A Q9Y5Y9 1/20 0.46
CACNA1G O43497 1/20 0.45
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
HSD17B10 Q99714 1/20 0.43
PLAAT3 P53816 1/20 0.42
PLAAT5 Q96KN8 1/20 0.42
PLAAT2 Q9NWW9 1/20 0.42
PLAAT4 Q9UL19 1/20 0.42
POLB P06746 1/20 0.42
PTGES O14684 1/20 0.41
CNR1 P21554 1/20 0.41

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
SCHEMBL6705567 0.91 ALDH1A1 (0.47) ALDH1A1LMNAPTGES
SCHEMBL6701422 0.91 HPGD (0.46) CACNA1GALDH1A1LMNAHSD17B10PTGES
SCHEMBL6704655 0.72 NPC1 (0.49) TP53MDM2ALDH1A1POLBCNR1
SCHEMBL5428707 0.72 HPGD (0.48) CACNA1GALDH1A1LMNAHSD17B10
SCHEMBL6701163 0.69 LMNA (0.40) LMNAPOLB
SCHEMBL5226231 0.68 HDAC6 (0.72) SCN2ASCN10AALDH1A1LMNAPOLB
SCHEMBL6699001 0.68 LMNA (0.46) ALDH1A1LMNAPOLB
SCHEMBL1926318 0.66 EPHX2 (0.77) SCN2ASCN10A
SCHEMBL3461078 0.65 HDAC6 (0.70) SCN2ASCN10AALDH1A1LMNAPOLB
SCHEMBL20764262 0.64 ESRRG (0.78) TP53MDM2SCN2ASCN10AALDH1A1

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 TP53 2243/4885MDM2 4040/4885SCN2A 1421/4885

“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.