SCHEMBL3094003

SCHEMBL3094003

CCOC(=O)Cc1ccc(OCc2c(C)cccc2C)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 1/20 0.49
TBXAS1 P24557 1/20 0.48
ALDH1A1 P00352 2/20 0.48
HPGD P15428 2/20 0.48
PPARG P37231 1/20 0.47
PPARA Q07869 1/20 0.47
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
TSHR P16473 1/20 0.46
KMT2A Q03164 1/20 0.46
HSD17B10 Q99714 1/20 0.46
ALOX5 P09917 3/20 0.46
MAOB P27338 3/20 0.45
ATM Q13315 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
NR1H4 Q96RI1 1/20 0.44
TP53 P04637 1/20 0.44
CYP4Z1 Q86W10 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL1010327 0.86 SLC22A12 (0.50) SLC22A12PPARGPPARATSHRMAOB
SCHEMBL954556 0.84 SLC22A12 (0.68) SLC22A12ALOX5NR1H4
SCHEMBL1203178 0.82 ALOX5 (0.67) ALDH1A1ALOX5MAOBL3MBTL1NR1H4
SCHEMBL1081012 0.82 SLC22A12 (0.74) SLC22A12ALDH1A1HPGDPPARGPPARA
SCHEMBL181473 0.81 HPGD (0.61) TBXAS1ALDH1A1HPGDCYP4Z1SMN1; SMN2
SCHEMBL10562538 0.81 ALDH1A1 (0.43) TBXAS1ALDH1A1HPGDKDM4EMEN1
SCHEMBL6904947 0.80 TBXAS1 (0.53) TBXAS1ALDH1A1HPGDMEN1KMT2A
SCHEMBL10564801 0.80 MAOB (0.44) TBXAS1ALDH1A1HPGDTSHRKMT2A
SCHEMBL2087071 0.80 NPC1 (0.49) ALDH1A1MAOBATMTDP1L3MBTL1
SCHEMBL1007810 0.79 SLC22A12 (0.58) SLC22A12ALDH1A1HPGDPPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100234464-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS WELLSTAT THERAPEUTICS CORPORATION (US) 2010-09-16 US disclosed
EP-2026659-A2 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS Wellstat Therapeutics Corporation (US) 2009-02-25 EP disclosed
WO-2007146768-A2 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS WELLSTAT THERAPEUTICS CORPORATION (US) 2007-12-21 WO 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-20100234464-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS PC, GOT2, OAT SLC22A12 1715/4885TBXAS1 585/4885ALDH1A1 1793/4885

“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.