SCHEMBL7861984

SCHEMBL7861984

CCCCCCCCCCCCCCOc1ccc(C(=O)CBr)cc1

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.69
TSHR P16473 1/20 0.69
THRA P10827 6/20 0.68
THRB P10828 6/20 0.68
PLA2G4B P0C869 6/20 0.67
RARB P10826 3/20 0.63
PLA2G4A P47712 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.59
GSK3B P49841 1/20 0.57

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
SCHEMBL8591116 1.00 TP53 (0.69) TP53TSHRTHRATHRBPLA2G4B
SCHEMBL1437711 1.00 TP53 (0.69) TP53TSHRTHRATHRBPLA2G4B
SCHEMBL7861703 1.00 TP53 (0.69) TP53TSHRTHRATHRBPLA2G4B
SCHEMBL14644865 1.00 TP53 (0.69) TP53TSHRTHRATHRBPLA2G4B
SCHEMBL4629110 1.00 TP53 (0.69) TP53TSHRTHRATHRBPLA2G4B
SCHEMBL2356907 0.98 TP53 (0.66) TP53TSHRTHRATHRBPLA2G4B
SCHEMBL5055145 0.95 L3MBTL1 (0.65) TP53TSHRTHRATHRBPLA2G4B
SCHEMBL7371927 0.94 RARB (0.68) TP53TSHRTHRATHRBPLA2G4B
SCHEMBL11657851 0.90 PLA2G4B (0.58) TP53TSHRTHRATHRBPLA2G4B
SCHEMBL5057170 0.88 L3MBTL1 (0.70) TP53TSHRTHRATHRBPLA2G4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0923529-B1 SUBSTITUTE 4-ARYLBUTYRIC ACID DERIVATIVES AS MATRIX METALLOPROTEASE INHIBITORS BAYER AG (US) 2001-09-19 EP disclosed
EP-0923529-A1 SUBSITUTE 4-ARYLBUTYRIC ACID DERIVATIVES AS MATRIX METALLOPROTEASE INHIBITORS Bayer Corporation (US) 1999-06-23 EP disclosed
US-5863915-A ENZYME INHIBITORS FOR BONES AND JOINTS BAYER CORPORATION (US) 1999-01-26 US disclosed
WO-1997043237-A1 SUBSITUTE 4-ARYLBUTYRIC ACID DERIVATIVES AS MATRIX METALLOPROTEASE INHIBITORS BAYER CORPORATION (US) 1997-11-20 WO disclosed
US-4204867-A THIAZOLE OR IMIDAZOLE FOUR EQUILVALENT COUPLERS AGFA-GEVAERT, A.G. (DE) 1980-05-27 US disclosed
US-4183752-A DEVELOPMENT INHIBITOR RELEASING THIOETHERS AGFA-GEVAERT AKTIENGESELLSCHAFT (DE) 1980-01-15 US disclosed