SCHEMBL9691643

SCHEMBL9691643

CO/C=C(/C(=O)O)c1scnc1COc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.38
NPC1 O15118 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
ALOX15 P16050 1/20 0.36
ABCC8 Q09428 1/20 0.36
KCNJ11 Q14654 1/20 0.36
KDR P35968 1/20 0.36
POLB P06746 1/20 0.36
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 2/20 0.35
MAPK1 P28482 1/20 0.35
LMNA P02545 2/20 0.34
HTT P42858 1/20 0.34
MAOB P27338 2/20 0.34
XIAP P98170 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL9666877 0.90 SMN1; SMN2 (0.39) RAB9ANPC1SMN1; SMN2ALOX15ABCC8
SCHEMBL9692016 0.84 RAB9A (0.37) RAB9ANPC1SMN1; SMN2ALOX15KDR
SCHEMBL9691327 0.81 MAPT (0.39) RAB9ANPC1SMN1; SMN2ABCC8KCNJ11
SCHEMBL9689720 0.80 PTPN11 (0.39) RAB9ANPC1SMN1; SMN2ABCC8KCNJ11
SCHEMBL9581101 0.79 RAB9A (0.37) RAB9ANPC1SMN1; SMN2ABCC8KCNJ11
SCHEMBL9691348 0.78 ABCC8 (0.37) RAB9ANPC1SMN1; SMN2ABCC8KCNJ11
SCHEMBL9691875 0.78 XIAP (0.39) RAB9ANPC1SMN1; SMN2ABCC8KCNJ11
SCHEMBL9668730 0.78 KDR (0.39) RAB9ANPC1SMN1; SMN2ALOX15KDR
SCHEMBL8965922 0.74 TRPA1 (0.37) RAB9ANPC1SMN1; SMN2POLBALDH1A1
SCHEMBL8639304 0.72 KDM4E (0.47) SMN1; SMN2ALOX15ALDH1A1KDM4EHTT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0508901-A2 Alpha-methylene-4-[(phenoxy)methyl)]5-thiazolacetic acid derivatives, process for their preparation, intermediates in this process, their use as fungicides and compositions containing them ROUSSEL UCLAF (FR) 1992-10-14 EP claimed
EP-0508901-A2 Alpha-methylene-4-[(phenoxy)methyl)]5-thiazolacetic acid derivatives, process for their preparation, intermediates in this process, their use as fungicides and compositions containing them ROUSSEL UCLAF (FR) 1992-10-14 EP disclosed