SCHEMBL8014177

SCHEMBL8014177

Cc1ccccc1OCc1ccccc1C(C(=O)O)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.51
RXRB P28702 1/20 0.51
RXRG P48443 1/20 0.51
SLC1A5 Q15758 1/20 0.48
FABP4 P15090 2/20 0.46
FABP5 Q01469 2/20 0.46
RECQL P46063 1/20 0.46
PTGDR2 Q9Y5Y4 1/20 0.46
NOTUM Q6P988 1/20 0.44
FFAR4 Q5NUL3 1/20 0.44
HTT P42858 2/20 0.44
POLB P06746 1/20 0.44
NPSR1 Q6W5P4 1/20 0.43
TDP1 Q9NUW8 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CDK4 P11802 1/20 0.43
CCND1 P24385 1/20 0.43
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 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
SCHEMBL15375447 0.87 FABP4 (0.57) RXRARXRBRXRGSLC1A5FABP4
SCHEMBL8305675 0.86 TDP1 (0.47) RXRARXRBRXRGSLC1A5FABP4
SCHEMBL8897564 0.85 FABP4 (0.61) RXRARXRBRXRGSLC1A5FABP4
SCHEMBL28038053 0.81 RXRA (0.45) RXRARXRBRXRGSLC1A5FABP4
SCHEMBL9051241 0.80 RXRA (0.46) RXRARXRBRXRGFABP4FABP5
SCHEMBL15375521 0.80 RXRA (0.46) RXRARXRBRXRGSLC1A5FABP4
SCHEMBL15614303 0.80 CDK4 (0.44) RXRARXRBRXRGFFAR4TDP1
SCHEMBL28038060 0.79 RXRA (0.43) RXRARXRBRXRGSLC1A5FABP4
SCHEMBL15375470 0.79 RXRA (0.45) RXRARXRBRXRGFABP4FABP5
SCHEMBL15375537 0.79 TDP1 (0.52) RXRARXRBRXRGSLC1A5FABP4

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
US-6022870-A 4-(HETEROCYCLE-SUBSTITUTED-PHENYL)-1,2,4-TRIAZOL-3-ONES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2000-02-08 US disclosed
EP-0729461-B1 FUNGICIDAL CYCLIC AMIDES DU PONT (US) 1999-11-24 EP disclosed
US-5977149-A Dihydrotriazole compounds and their use for controlling fungal plant diseases E. I. DU PONT DE NEMOURS AND COMPANY (US) 1999-11-02 US disclosed
WO-1996036615-A1 FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1996-11-21 WO disclosed
EP-0729461-A1 FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1996-09-04 EP disclosed
WO-1995014009-A1 FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1995-05-26 WO disclosed