SCHEMBL4032476

SCHEMBL4032476

Cc1noc(-c2ccc(F)cc2)c1N(C(=O)O)C(C)c1ccccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 5/20 0.43
LPAR3 Q9UBY5 4/20 0.43
LPAR2 Q9HBW0 2/20 0.43
KMT2A Q03164 5/20 0.36
MEN1 O00255 4/20 0.36
KDM4E B2RXH2 2/20 0.35
MAPT P10636 1/20 0.35
GPBAR1 Q8TDU6 1/20 0.35
CTSA P10619 2/20 0.35
FTO Q9C0B1 1/20 0.34
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ATM Q13315 1/20 0.33
TSHR P16473 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL4034108 0.92 LPAR1 (0.44) LPAR1LPAR3LPAR2KMT2AMEN1
SCHEMBL4034159 0.92 LPAR1 (0.44) LPAR1LPAR3LPAR2KMT2AMEN1
SCHEMBL4030964 0.90 HDAC3 (0.39) LPAR1LPAR3LPAR2KMT2AMEN1
SCHEMBL15437576 0.90 LPAR1 (0.43) LPAR1LPAR3LPAR2KMT2AMEN1
SCHEMBL4032913 0.88 LPAR1 (0.42) LPAR1LPAR3LPAR2KMT2AMEN1
SCHEMBL4034499 0.88 LPAR1 (0.48) LPAR1LPAR3LPAR2KMT2AMEN1
SCHEMBL4033894 0.88 LPAR1 (0.44) LPAR1LPAR3LPAR2KMT2AMEN1
SCHEMBL4037529 0.87 CTSA (0.37) LPAR1LPAR3LPAR2KMT2AMEN1
SCHEMBL4036790 0.87 TRPA1 (0.46) LPAR1LPAR3LPAR2KDM4EMAPT
SCHEMBL4028781 0.87 LPAR1 (0.42) LPAR1LPAR3LPAR2KMT2AMEN1

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-1258484-B1 NOVEL ISOXAZOLE AND THIAZOLE COMPOUNDS AND USE THEREOF AS DRUGS KYOWA HAKKO KIRIN CO LTD (JP) 2009-01-14 EP claimed