SCHEMBL4033847

SCHEMBL4033847

Cc1noc(-c2cccc(CSCCc3ccccc3)c2)c1NC(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 4/20 0.49
LPAR3 Q9UBY5 3/20 0.49
LPAR2 Q9HBW0 2/20 0.49
KDM4E B2RXH2 2/20 0.46
MAPT P10636 2/20 0.46
LMNA P02545 3/20 0.43
ALDH1A1 P00352 3/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
PKM P14618 1/20 0.42
TP53 P04637 2/20 0.41
SENP1 Q9P0U3 1/20 0.40
PTGER1 P34995 1/20 0.39
PTGER4 P35408 1/20 0.39
PTGER3 P43115 1/20 0.39
PTGER2 P43116 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HPGD P15428 2/20 0.39
HSD17B10 Q99714 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39

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
SCHEMBL4036981 0.89 MAPT (0.45) LPAR1LPAR3LPAR2KDM4EMAPT
SCHEMBL4029811 0.89 LPAR1 (0.57) LPAR1LPAR3LPAR2KDM4EMAPT
SCHEMBL4034283 0.83 LPAR1 (0.74) LPAR1LPAR3LPAR2KDM4EMAPT
SCHEMBL4031711 0.82 MAPT (0.51) LPAR1LPAR3LPAR2KDM4EMAPT
SCHEMBL4032711 0.80 LPAR1 (0.48) LPAR1LPAR3LPAR2KDM4EMAPT
SCHEMBL4035675 0.78 MAPT (0.67) LPAR1LPAR3LPAR2KDM4EMAPT
SCHEMBL4032632 0.78 LPAR1 (0.47) LPAR1LPAR3LPAR2KDM4EMAPT
SCHEMBL4034651 0.78 LPAR1 (0.41) LPAR1LPAR3LPAR2KDM4EMAPT
SCHEMBL4034142 0.77 LPAR1 (0.54) LPAR1LPAR3LPAR2KDM4EMAPT
SCHEMBL4034814 0.77 MAPT (0.53) LPAR1LPAR3KDM4EMAPTALDH1A1

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