SCHEMBL7956154

SCHEMBL7956154

CC(=O)OOc1cccc2c(CCO)c(C)oc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 8/20 0.39
PTGIR P43119 7/20 0.39
THRB P10828 2/20 0.32
THRA P10827 1/20 0.32
ALDH1A1 P00352 2/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32
PTGS2 P35354 1/20 0.32
APEX1 P27695 1/20 0.32
GAA P10253 2/20 0.32
PTPN1 P18031 1/20 0.32
MAPT P10636 2/20 0.31
PKM P14618 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
HPGD P15428 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
BCL2 P10415 1/20 0.31
BCL2L1 Q07817 1/20 0.31

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
SCHEMBL7956160 0.87 ADORA2A (0.42) TBXA2RPTGIRALDH1A1HTTPTGS2
SCHEMBL7959173 0.81 MAOA (0.43) TBXA2RPTGIRALDH1A1TSHRHTT
SCHEMBL7956157 0.80 TBXA2R (0.58) TBXA2RPTGIRTHRBTHRAALDH1A1
SCHEMBL7958897 0.75 PTGIR (0.44) TBXA2RPTGIRTHRBALDH1A1TSHR
SCHEMBL7956254 0.69 MAPT (0.44) THRBALDH1A1HTTGAAPTPN1
SCHEMBL7948857 0.68 TBXA2R (0.50) TBXA2RPTGIRTHRBTHRAALDH1A1
SCHEMBL7956762 0.68 MEN1 (0.46) ALDH1A1TSHRHTTGAAMAPT
SCHEMBL7948600 0.67 TBXA2R (0.39) TBXA2RPTGIRALDH1A1TSHRHTT
SCHEMBL7959241 0.66 TBXA2R (0.62) TBXA2RPTGIRALDH1A1HPGDL3MBTL1
SCHEMBL8318696 0.66 TSHR (0.47) ALDH1A1TSHRHTTPTGS2APEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6323235-B1 CARDIOVASCULAR DISORDERS, ANTIISCHEMIC AGENTS AND ENZYME INHIBITORS OHTAKE ATSUSHI (JP) 2001-11-27 US disclosed
US-6043264-A A THROMBOXANE A2 RECEPTOR ANTAGONIST FOR TREATING HYPERTENSION, THROMBOSIS, ISCHEMIC HEART DISEASES, CIRCULATORY DISEASES, ARTERIOSCLEROSIS, PLATELET FUNCTION DISORDER, HYPERLIPIDEMIA, NEPHRITIS OR ASTHMA TORAY INDUSTRIES, INC. (JP) 2000-03-28 US disclosed
EP-0751126-A1 BENZENE-FUSED HETEROCYCLIC DERIVATIVE AND USE OF THE SAME TORAY INDUSTRIES, INC. (JP) 1997-01-02 EP disclosed