SCHEMBL6703375

SCHEMBL6703375

CCCCNC(=O)C1OC(=O)C=C1c1ccc(Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.43
MDM2 Q00987 1/20 0.43
THRB P10828 1/20 0.41
KCNA5 P22460 2/20 0.39
KCNH2 Q12809 1/20 0.39
HPGD P15428 1/20 0.39
LMNA P02545 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
MAPT P10636 2/20 0.39
ALDH1A1 P00352 2/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.37
CNR1 P21554 1/20 0.37

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
SCHEMBL6700580 0.88 HPGD (0.44) HPGDHDAC3HDAC1HDAC2MAPT
SCHEMBL6700774 0.88 HPGD (0.46) HPGDHDAC3HDAC1HDAC2MAPT
SCHEMBL6701630 0.74 HPGD (0.41) HPGDMAPTALDH1A1TSHRKMT2A
SCHEMBL13127007 0.65 NPC1 (0.56) LMNASMN1; SMN2MAPTALDH1A1TSHR
SCHEMBL6359381 0.65 HDAC3 (0.71) HPGDSMN1; SMN2HDAC3HDAC1HDAC2
SCHEMBL8544861 0.64 SMPD1 (0.53) TP53MDM2THRBHPGDSMN1; SMN2
SCHEMBL10585478 0.63 CNR1 (0.69) LMNASMN1; SMN2HDAC1HDAC2MAPT
SCHEMBL20772601 0.62 TP53 (0.47) TP53MDM2HPGDLMNASMN1; SMN2
SCHEMBL712405 0.62 MAPK1 (0.46) THRBKCNA5KCNH2HPGDLMNA
SCHEMBL13719645 0.61 POLB (0.65) TP53THRBLMNAMAPTALDH1A1

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 4040/4885THRB 1549/4885

“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.