Sugi Predict

Sugi Predict / Compounds / SCHEMBL23544206

SCHEMBL23544206

SCHEMBL23544206

C=C(C)CCOCCCCCNC(=C)CCCCCCCC

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 10/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ EPHX1 P07099 5/20 0.38
▸ CES2 O00748 1/20 0.38
▸ CASP2 P42575 1/20 0.38
▸ FAAH O00519 1/20 0.36

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
SCHEMBL22271235 0.92 MEN1 (0.46) EPHX2MEN1THRBHTTKMT2A
SCHEMBL22418273 0.85 CASP2 (0.46) EPHX2EPHX1CASP2FAAH
SCHEMBL20665091 0.85 CES2 (0.39) EPHX2EPHX1CES2CASP2FAAH
SCHEMBL9398009 0.83 HTT (0.54) MEN1THRBHTTKMT2AMAPT
SCHEMBL24483720 0.82 CASP2 (0.41) EPHX2EPHX1CASP2FAAH
SCHEMBL24483714 0.82 CASP2 (0.41) EPHX2EPHX1CASP2FAAH
SCHEMBL19006669 0.82 PLA2G4A (0.42) EPHX1CASP2FAAH
SCHEMBL24041036 0.82 EPHX1 (0.52) EPHX2EPHX1CASP2FAAH
SCHEMBL21527587 0.82 EPHX1 (0.52) EPHX2EPHX1CASP2FAAH
SCHEMBL20903683 0.82 EPHX1 (0.52) EPHX2EPHX1CASP2FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3447067-B1 GLP-1R/GCGR DUAL TARGET AGONIST POLYPEPTIDE FOR TREATING NON-ALCOHOLIC FATTY LIVER DISEASES SHENZHEN TURIER BIOTECH CO LTD (CN) 2021-06-23 — — EP disclosed