SCHEMBL4475698

SCHEMBL4475698

CCc1c(OC(C)=O)c(C(C)C)cc(O)c1C(C)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.37
ALOX5 P09917 1/20 0.37
CYP3A4 P08684 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 2/20 0.35
KDM4E B2RXH2 4/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
ALDH1A1 P00352 1/20 0.35
HSP90AB1 P08238 2/20 0.34
MAPT P10636 2/20 0.34
TP53 P04637 1/20 0.34
GAA P10253 1/20 0.34
HTT P42858 1/20 0.34
PKM P14618 2/20 0.33
USP2 O75604 1/20 0.33
MAPK1 P28482 1/20 0.33
CYP1A2 P05177 1/20 0.33
ADRA2A P08913 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
SCHEMBL27708365 0.89 PTGES (0.35) PTGESALOX5CYP3A4MEN1KMT2A
SCHEMBL4469962 0.82 CYP3A4 (0.39) PTGESALOX5CYP3A4MEN1KMT2A
SCHEMBL4462555 0.81 KDM4E (0.51) CYP3A4MEN1KMT2AHPGDHSD17B10
SCHEMBL4465924 0.81 CYP3A4 (0.41) PTGESALOX5CYP3A4MEN1KMT2A
SCHEMBL4470434 0.77 ALOX5 (0.40) PTGESALOX5CYP3A4MEN1KMT2A
SCHEMBL27688768 0.77 CYP3A4 (0.37) ALOX5CYP3A4MEN1KMT2AHPGD
SCHEMBL6768274 0.72 PREP (0.42) CYP3A4HSD17B10KDM4ESMN1; SMN2MAPT
SCHEMBL4464395 0.71 CYP3A4 (0.40) ALOX5CYP3A4MEN1KMT2AHPGD
SCHEMBL29113877 0.71 HTT (0.38) HSD17B10KDM4ESMN1; SMN2MAPTTP53
SCHEMBL1928602 0.71 GABRA1 (0.40) SMN1; SMN2HTTPKMCYP1A2ADRA2A

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 5 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
CN-101115734-A Spiro derivatives as lipoxygenase inhibitors LILLY CO ELI (US) 2008-01-30 CN disclosed
EP-1836183-A2 SPIRO DERIVATIVES AS LIPOXYGENASE INHIBITORS Galileo Pharmaceuticals, Inc. (US) 2007-09-26 EP disclosed
WO-2006065686-A2 SPIRO DERIVATIVES AS LIPOXYGENASE INHIBITORS GALILEO PHARMACEUTICALS, INC. (US) 2006-06-22 WO 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 PTGES 10/4885ALOX5 2/4885CYP3A4 317/4885

“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.