SCHEMBL9447706

SCHEMBL9447706

CCCCCCCSc1ccccc1O

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.64
PTGS2 P35354 5/20 0.56
CYSLTR2 Q9NS75 1/20 0.50
CYSLTR1 Q9Y271 1/20 0.50
NAAA Q02083 1/20 0.45
P4HB P07237 1/20 0.44
SOAT1 P35610 8/20 0.43
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
ATM Q13315 1/20 0.42

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
SCHEMBL5313693 1.00 EPHX2 (0.64) EPHX2PTGS2CYSLTR2CYSLTR1NAAA
SCHEMBL22444760 1.00 EPHX2 (0.64) EPHX2PTGS2CYSLTR2CYSLTR1NAAA
SCHEMBL19066580 1.00 EPHX2 (0.64) EPHX2PTGS2CYSLTR2CYSLTR1NAAA
SCHEMBL2070118 0.98 EPHX2 (0.62) EPHX2PTGS2CYSLTR2CYSLTR1NAAA
SCHEMBL9323113 0.92 EPHX2 (0.56) EPHX2PTGS2CYSLTR2CYSLTR1NAAA
SCHEMBL31359159 0.90 EPHX2 (0.52) EPHX2PTGS2CYSLTR2CYSLTR1P4HB
SCHEMBL28891540 0.84 EPHX2 (0.50) EPHX2PTGS2CYSLTR2CYSLTR1P4HB
SCHEMBL28404539 0.84 EPHX2 (0.50) EPHX2PTGS2CYSLTR2CYSLTR1P4HB
SCHEMBL28397899 0.84 EPHX2 (0.50) EPHX2PTGS2CYSLTR2CYSLTR1P4HB
SCHEMBL10504004 0.84 PTGS2 (0.51) EPHX2PTGS2P4HBSOAT1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113574041-B Bisphenol production method and polycarbonate resin production method 三菱化学株式会社 2023-10-13 CN disclosed
WO-2020189201-A1 METHOD FOR PRODUCING BISPHENOL AND METHOD FOR PRODUCING POLYCARBONATE RESIN 三菱ケミカル株式会社 2020-09-24 WO disclosed
EP-0539572-A1 LOW-SULFUR DIESEL FUELS CONTAINING ORGANOMETALLIC COMPLEXES The Lubrizol Corporation (US) 1993-05-05 EP disclosed
EP-0539576-A1 ORGANOMETALLIC COMPLEX-ANTIOXIDANT COMBINATIONS, AND CONCENTRATES AND DIESEL FUELS CONTAINING SAME. LUBRIZOL CORP (US) 1993-05-05 EP disclosed
EP-0539579-A1 DIESEL FUELS CONTAINING ORGANOMETALLIC COMPLEXES The Lubrizol Corporation (US) 1993-05-05 EP disclosed