SCHEMBL2293365

SCHEMBL2293365

O=C[C@H](Cc1ccc(Oc2ccc(Oc3ccccc3)cc2)cc1)NC(=O)O

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 5/20 0.53
FFAR1 O14842 1/20 0.50
ACACB O00763 1/20 0.49
PPARG P37231 5/20 0.49
PPARA Q07869 5/20 0.49
CTSB P07858 2/20 0.48

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
SCHEMBL17865652 0.86 CAPN1 (0.61) CAPN1CTSB
SCHEMBL2369340 0.86 CAPN1 (0.61) CAPN1CTSB
SCHEMBL3292711 0.86 CAPN1 (0.61) CAPN1CTSB
SCHEMBL3719359 0.85 CAPN1 (0.62) CAPN1FFAR1PPARGPPARACTSB
SCHEMBL20529415 0.85 CAPN1 (0.62) CAPN1FFAR1PPARGPPARACTSB
SCHEMBL18262577 0.84 LDHA (0.57) CAPN1ACACBPPARGPPARACTSB
SCHEMBL16932220 0.83 CAPN1 (0.52) CAPN1CTSB
SCHEMBL1286249 0.80 ACACB (0.50) CAPN1ACACBPPARGPPARACTSB
SCHEMBL2545520 0.79 CAPN1 (0.62) CAPN1
SCHEMBL17923806 0.79 ACACB (0.69) FFAR1ACACBPPARGPPARA

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-7989480-B2 Aryl amino acid derivatives as inhibitors for treating inflammation DECODE GENETICS EHF (IS) 2011-08-02 US disclosed
US-20080033024-A1 ARYL AMINO ACID DERIVATIVES AS INHIBITORS FOR TREATING INFLAMMATION DECODE GENETICS EHF. (IS) 2008-02-07 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-20080033024-A1 ARYL AMINO ACID DERIVATIVES AS INHIBITORS FOR TREATING INFLAMMATION LTA4H, LTB4R2, LTB4R CAPN1 4026/4885FFAR1 338/4885ACACB 1829/4885

“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.