SCHEMBL4028262

SCHEMBL4028262

Cc1noc(-c2ccc(F)cc2F)c1NC(=O)O

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.43
P2RX7 Q99572 1/20 0.41
HTT P42858 1/20 0.41
MAPT P10636 3/20 0.40
POLB P06746 1/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
RAB9A P51151 6/20 0.39
NPC1 O15118 5/20 0.39
LPAR1 Q92633 1/20 0.39
LPAR3 Q9UBY5 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
FAAH O00519 1/20 0.38
KMO O15229 1/20 0.38
ALPL P05186 1/20 0.38
TP53 P04637 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
FTO Q9C0B1 1/20 0.38

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) MAPTKDM4EGAARAB9ANPC1
SCHEMBL15880627 0.83 HTT (0.45) P2RX7HTTMAPTKDM4ERAB9A
SCHEMBL12466023 0.82 KIT (0.41) MAPTKDM4E
SCHEMBL4034870 0.80 MAPT (0.52) HTTMAPTKDM4ERAB9ANPC1
SCHEMBL4037473 0.78 MAPT (0.51) MAPTKDM4EGAALPAR1LPAR3
SCHEMBL4037532 0.77 LPAR1 (0.61) MAPTKDM4ELPAR1LPAR3CYP2C9
SCHEMBL4031767 0.72 MAPT (0.47) P2RX7MAPTKDM4ERAB9ANPC1
SCHEMBL4035675 0.72 MAPT (0.67) HTTMAPTKDM4ELPAR1LPAR3
SCHEMBL29775952 0.71 KMO (0.44) HTTMAPTPOLBKDM4ERAB9A
SCHEMBL11902725 0.71 KMO (0.44) HTTMAPTPOLBKDM4ERAB9A

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