SCHEMBL15831788

SCHEMBL15831788

OCc1ccc(Oc2cccc(Oc3ccccc3)c2)cc1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.84
TTR P02766 1/20 0.58
ALDH1A1 P00352 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
NR1H2 P55055 2/20 0.50
TSHR P16473 2/20 0.50
FFAR1 O14842 2/20 0.50
MEN1 O00255 1/20 0.50
MITF O75030 1/20 0.50
GAA P10253 1/20 0.50
MAPT P10636 1/20 0.50
GFER P55789 1/20 0.50
KMT2A Q03164 1/20 0.50
NLRP1 Q9C000 1/20 0.50
NOD2 Q9HC29 1/20 0.50
NR1H3 Q13133 1/20 0.50
ST14 Q9Y5Y6 1/20 0.50
KDM4E B2RXH2 1/20 0.49
HTT P42858 1/20 0.49
SRD5A2 P31213 1/20 0.49

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
SCHEMBL510065 0.92 LTA4H (1.00) LTA4HTTRNR1H2TSHRFFAR1
SCHEMBL1744936 0.92 LTA4H (1.00) LTA4HTTRNR1H2TSHRFFAR1
SCHEMBL28009008 0.90 LTA4H (0.95) LTA4HTTRNR1H2TSHRFFAR1
SCHEMBL28009007 0.90 LTA4H (0.95) LTA4HTTRNR1H2TSHRFFAR1
SCHEMBL29661187 0.86 LTA4H (0.67) LTA4HTTRALDH1A1SMN1; SMN2TSHR
SCHEMBL358425 0.86 LTA4H (0.67) LTA4HTTRALDH1A1SMN1; SMN2TSHR
Diphenylether SCHEMBL27843672 0.85 LTA4H (0.86) LTA4HTTRALDH1A1NR1H2TSHR
SCHEMBL12885428 0.85 LTA4H (0.66) LTA4HTTRALDH1A1SMN1; SMN2NR1H2
SCHEMBL17984374 0.85 LTA4H (0.60) LTA4HTTRALDH1A1SMN1; SMN2TSHR
Methane SCHEMBL10579323 0.84 LTA4H (0.64) LTA4HTTRALDH1A1SMN1; SMN2TSHR

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-9051229-B2 Transition metal catalysts for C—O hydrogenolysis and hydrodeoxygenation GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 2015-06-09 US disclosed
US-20140179954-A1 TRANSITION METAL CATALYSTS FOR C-O HYDROGENOLYSIS AND HYDRODEOXYGENATION GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 2014-06-26 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-20140179954-A1 TRANSITION METAL CATALYSTS FOR C-O HYDROGENOLYSIS AND HYDRODEOXYGENATION HMOX1, HAO2, PPOX LTA4H 2213/4885TTR 4171/4885ALDH1A1 2882/4885

“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.