SCHEMBL4479211

SCHEMBL4479211

Cc1ccc2c(c1O)OCC1(CCC1)C2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.36
KDM4E B2RXH2 3/20 0.30
MAPT P10636 3/20 0.30
HPGD P15428 3/20 0.30
RECQL P46063 3/20 0.30
TDP1 Q9NUW8 3/20 0.30
ALDH1A1 P00352 2/20 0.30
CYP3A4 P08684 2/20 0.30
G6PD P11413 2/20 0.30
HSD17B10 Q99714 2/20 0.30
L3MBTL1 Q9Y468 2/20 0.30
MAPK1 P28482 2/20 0.30
NSD2 O96028 1/20 0.30
TSHR P16473 1/20 0.30
CASP7 P55210 1/20 0.30
CASP6 P55212 1/20 0.30
MEN1 O00255 1/20 0.30
FGB P02675 1/20 0.30
PRNP P04156 1/20 0.30
TP53 P04637 1/20 0.30

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
SCHEMBL4464566 0.72 AKT1 (0.36) KDM4EMAPTHPGDRECQLTDP1
SCHEMBL14188421 0.68 MAOA (0.33) CYP1A2KDM4EMAPTHPGDALDH1A1
SCHEMBL4462418 0.68 PTGS1 (0.38) CYP1A2MAPTCYP3A4TSHRMEN1
SCHEMBL4464006 0.68 ACHE (0.33)
SCHEMBL2046624 0.67 PARP1 (0.41) CYP1A2KDM4EMAPTHPGDALDH1A1
SCHEMBL4468522 0.65 ENTPD5 (0.40) KDM4EMAPTHPGDALDH1A1CYP3A4
SCHEMBL4475116 0.65 AKT1 (0.37) KDM4EMAPTHPGDRECQLTDP1
SCHEMBL9923814 0.61 ESR1 (0.34)
SCHEMBL28840800 0.61 BACE1 (0.41) MAPT
SCHEMBL33479 0.59

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 4 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
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 CYP1A2 136/4885KDM4E 3310/4885MAPT 4822/4885

“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.