SCHEMBL4459615

SCHEMBL4459615

OB(OOCC(COCc1ccccc1)OCc1ccccc1)c1ccccc1F

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
TP53 P04637 1/20 0.38
GAA P10253 1/20 0.38
KMT2A Q03164 1/20 0.38
CA1 P00915 4/20 0.37
CA2 P00918 2/20 0.37
CA7 P43166 2/20 0.37
CA9 Q16790 2/20 0.37
LIPE Q05469 1/20 0.34
TACR1 P25103 2/20 0.33
TSHR P16473 2/20 0.33
HSP90AA1 P07900 1/20 0.33
SLC1A1 P43005 1/20 0.33
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 1/20 0.32
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL4535810 0.75 TSHR (0.58) MEN1KMT2ACA1CA2CA7
SCHEMBL4459609 0.72 LIPE (0.48) MEN1TP53GAAKMT2ACA1
SCHEMBL177451 0.71 PPARD (0.39) MEN1TP53GAAKMT2ACA1
SCHEMBL177450 0.71 PPARD (0.39) MEN1TP53GAAKMT2ACA1
SCHEMBL9575753 0.70 TSHR (0.52) MEN1KMT2ACA1CA2CA7
SCHEMBL19068463 0.70 CA1 (0.49) MEN1KMT2ACA1CA2CA7
SCHEMBL4537628 0.69 CA1 (0.51) MEN1KMT2ACA1CA2CA7
SCHEMBL828589 0.69 CA1 (0.51) MEN1KMT2ACA1CA2CA7
SCHEMBL8904530 0.69 CA1 (0.51) MEN1KMT2ACA1CA2CA7
SCHEMBL6139421 0.68 SLC1A1 (0.48) MEN1KMT2ACA1CA2CA7

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-8629125-B2 Inhibitors of fatty acid amide hydrolase Infinty Pharmaceuticals, Inc. (US) 2014-01-14 US disclosed
US-20130059819-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE INFINITY PHARMACEUTICALS, INC. (US) 2013-03-07 US disclosed
EP-2073816-A2 INHIBITORS OF FATTY ACID AMIDE HYDROLASE Infinity Pharmaceuticals, Inc. (US) 2009-07-01 EP disclosed
WO-2008063300-A2 BORONIC ACIDS AND ESTERS AS INHIBITORS OF FATTY ACID AMIDE HYDROLASE INFINITY PHARMACEUTICALS, INC. (US) 2008-05-29 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-20130059819-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE FAAH, FAAH2, ASAH1 MEN1 3210/4885TP53 4882/4885GAA 368/4885

“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.