SCHEMBL27664671

SCHEMBL27664671

CCC(C)COC(=O)c1csc(N(C(=O)c2ccccc2Cl)c2ccc(Cl)cc2)n1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
DHODH Q02127 4/20 0.36
EGFR P00533 1/20 0.36
ADRB2 P07550 1/20 0.35
ADRB1 P08588 1/20 0.35
ADRB3 P13945 1/20 0.35
TP53 P04637 1/20 0.35
POLB P06746 2/20 0.34
BCHE P06276 1/20 0.34
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL28758171 0.92 ALDH1A1 (0.41) MAPTRAB9ANPC1ALDH1A1KDM4E
SCHEMBL5035190 0.89 MAPT (0.49) MAPTRAB9ANPC1ALDH1A1KDM4E
SCHEMBL6488544 0.82 ALDH1A1 (0.42) MAPTRAB9ANPC1ALDH1A1KDM4E
SCHEMBL5034815 0.80 KDM4E (0.43) MAPTRAB9ANPC1ALDH1A1KDM4E
SCHEMBL5034980 0.79 KDM4E (0.47) MAPTRAB9AALDH1A1KDM4EHTT
SCHEMBL5032543 0.79 LMNA (0.48) MAPTRAB9ANPC1ALDH1A1KDM4E
SCHEMBL5032531 0.78 KDM4E (0.41) MAPTRAB9AALDH1A1KDM4EHTT
SCHEMBL5032616 0.78 KDM4E (0.41) MAPTRAB9ANPC1ALDH1A1KDM4E
Propylamine SCHEMBL6488547 0.78 KDM4E (0.46) MAPTRAB9AALDH1A1KDM4EHTT
Methylethylamine SCHEMBL6488540 0.78 KDM4E (0.43) RAB9AALDH1A1KDM4EHTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100509808-C Novel thiazole derivates HOFFMANN LA ROCHE (CH) 2009-07-08 CN claimed
CN-1890236-A Novel thiazole derivates HOFFMANN LA ROCHE (CH) 2007-01-03 CN claimed
CN-100509808-C Novel thiazole derivates HOFFMANN LA ROCHE (CH) 2009-07-08 CN disclosed
CN-1890236-A Novel thiazole derivates HOFFMANN LA ROCHE (CH) 2007-01-03 CN disclosed