SCHEMBL4034814

SCHEMBL4034814

Cc1cccc(-c2onc(C)c2NC(=O)O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.53
KDM4E B2RXH2 2/20 0.53
IP6K1 Q92551 2/20 0.52
IP6K3 Q96PC2 2/20 0.52
IP6K2 Q9UHH9 2/20 0.52
LPAR1 Q92633 3/20 0.52
LPAR3 Q9UBY5 1/20 0.52
ALDH1A1 P00352 4/20 0.49
HTT P42858 2/20 0.49
GAA P10253 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
RORC P51449 1/20 0.48
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
THRB P10828 1/20 0.42
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
RXRG P48443 1/20 0.41
BRD4 O60885 1/20 0.41
NPC1 O15118 1/20 0.41

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
SCHEMBL4035675 0.86 MAPT (0.67) MAPTKDM4EIP6K1IP6K3IP6K2
SCHEMBL4037473 0.86 MAPT (0.51) MAPTKDM4EIP6K1IP6K3IP6K2
SCHEMBL4030049 0.86 MAPT (0.60) MAPTKDM4ELPAR1LPAR3ALDH1A1
SCHEMBL4031711 0.83 MAPT (0.51) MAPTKDM4ELPAR1LPAR3ALDH1A1
SCHEMBL4037272 0.82 MAPT (0.54) MAPTKDM4EIP6K1IP6K3IP6K2
SCHEMBL4030546 0.82 MAPT (0.47) MAPTKDM4ELPAR1LPAR3ALDH1A1
SCHEMBL4030555 0.82 MAPT (0.47) MAPTKDM4ELPAR1LPAR3ALDH1A1
SCHEMBL4027907 0.81 LPAR1 (0.83) MAPTKDM4EIP6K1IP6K3IP6K2
SCHEMBL4032711 0.81 LPAR1 (0.48) MAPTKDM4ELPAR1LPAR3ALDH1A1
SCHEMBL4029111 0.80 LPAR1 (0.47) MAPTKDM4ELPAR1LPAR3BRD4

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