SCHEMBL4468435

SCHEMBL4468435

CC(=O)Oc1c(C)cc2c(c1C)C(=O)CC1(CCC1)O2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.44
HTT P42858 1/20 0.43
ATM Q13315 1/20 0.43
ALDH1A1 P00352 8/20 0.40
HPGD P15428 6/20 0.40
HSD17B10 Q99714 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
KLK7 P49862 1/20 0.38
KMT2A Q03164 1/20 0.38
ACACB O00763 3/20 0.37
GAA P10253 4/20 0.36
TSHR P16473 1/20 0.36
CASP1 P29466 3/20 0.36
HDAC3 O15379 2/20 0.35
HDAC4 P56524 2/20 0.35
HDAC1 Q13547 2/20 0.35
HDAC7 Q8WUI4 2/20 0.35
HDAC2 Q92769 2/20 0.35

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
SCHEMBL4462456 0.86 KDM4E (0.41) KDM4EHTTATMALDH1A1HPGD
SCHEMBL4466020 0.80 KDM4E (0.46) KDM4EHTTATMALDH1A1HPGD
SCHEMBL4468788 0.79 KMT2A (0.38) KDM4EHTTATMALDH1A1HPGD
SCHEMBL4464500 0.75 KDM4E (0.38) KDM4EHTTATMALDH1A1HPGD
SCHEMBL4470869 0.73 KDM4E (0.35) KDM4EHTTATMALDH1A1HPGD
SCHEMBL4473238 0.72 KDM4E (0.43) KDM4EHTTATMALDH1A1HPGD
SCHEMBL4470453 0.71 BACE1 (0.34) LMNA
SCHEMBL16335052 0.70 KDM4E (0.50) KDM4EHTTATMALDH1A1HPGD
SCHEMBL4475203 0.70 TRPV3 (0.31) LMNA
SCHEMBL5793490 0.69 HSP90AA1 (0.41) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7576094-B2 Spiro derivatives as lipoxygenase inhibitors ELI LILLY AND COMPANY (US) 2009-08-18 US disclosed
US-20060128790-A1 Spiro derivatives as lipoxygenase inhibitors GALILEO PHARMACEUTICALS, INC. 2006-06-15 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-20060128790-A1 Spiro derivatives as lipoxygenase inhibitors ALOX15B, ALOX5, ALOX15 KDM4E 3310/4885HTT 3071/4885ATM 3645/4885

“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.