SCHEMBL4031767

SCHEMBL4031767

Cc1noc(-c2ccccc2Br)c1NC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.47
KDM4E B2RXH2 1/20 0.47
LPAR1 Q92633 4/20 0.46
LPAR3 Q9UBY5 2/20 0.46
P2RX7 Q99572 1/20 0.41
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
GHSR Q92847 1/20 0.39
ABCC3 O15438 1/20 0.38
ABCC4 O15439 1/20 0.38
ABCB11 O95342 1/20 0.38
CYP2C8 P10632 1/20 0.38
CYP2C9 P11712 1/20 0.38
ABCB4 P21439 1/20 0.38
ABCC2 Q92887 1/20 0.38
SLCO1B3 Q9NPD5 1/20 0.38
SLCO1B1 Q9Y6L6 1/20 0.38
STAT3 P40763 1/20 0.38
EDNRA P25101 3/20 0.37

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
SCHEMBL4031817 0.83 MAPT (0.47) MAPTKDM4ELPAR1LPAR3ALDH1A1
SCHEMBL4035675 0.80 MAPT (0.67) MAPTKDM4ELPAR1LPAR3ALDH1A1
SCHEMBL15880627 0.77 HTT (0.45) MAPTKDM4ELPAR1LPAR3P2RX7
SCHEMBL6003 0.77 LPAR1 (0.54) MAPTKDM4ELPAR1LPAR3ALDH1A1
SCHEMBL4028279 0.77 LPAR1 (0.64) MAPTKDM4ELPAR1LPAR3MEN1
SCHEMBL29154153 0.76 MAPT (0.41) MAPTKDM4ELPAR1LPAR3ALDH1A1
SCHEMBL4037272 0.73 MAPT (0.54) MAPTKDM4ELPAR1LPAR3ALDH1A1
SCHEMBL3711198 0.72 LPAR1 (0.42) MAPTKDM4ELPAR1LPAR3ALDH1A1
SCHEMBL4028262 0.72 DPP4 (0.43) MAPTKDM4ELPAR1LPAR3P2RX7
SCHEMBL4287924 0.72 MAPT (0.44) MAPTKDM4ELPAR1LPAR3ALDH1A1

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