SCHEMBL11222994

SCHEMBL11222994

CCOc1ccc2sc3nc(C(=O)O)cn3c2c1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 2/20 0.48
▸ TP53 P04637 3/20 0.47
▸ MAPT P10636 3/20 0.47
▸ PTGER1 P34995 1/20 0.44
▸ PDE11A Q9HCR9 1/20 0.43
▸ THRB P10828 2/20 0.41
▸ PPARA Q07869 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ SMN1; SMN2 Q16637 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
SCHEMBL11222988 0.90 HSD17B10 (0.56) HSD17B10TP53MAPTPDE11ATHRB
SCHEMBL6703523 0.79 PARP15 (0.49) TP53MAPTTHRBKDM4EALDH1A1
SCHEMBL11011840 0.78 MAPT (0.60) TP53MAPTTHRBKDM4EALDH1A1
SCHEMBL11037111 0.78 MAPT (0.60) TP53MAPTTHRBKDM4EALDH1A1
SCHEMBL17621004 0.77 THRB (0.41) MAPTTHRBPPARA
SCHEMBL17620857 0.76 TP53 (0.64) TP53MAPTTHRBKDM4EALDH1A1
SCHEMBL17621065 0.75 SRD5A2 (0.49) TP53MAPTTHRBTSHRSMN1; SMN2
SCHEMBL18548699 0.75 TP53 (0.43) HSD17B10TP53MAPTKDM4ETSHR
SCHEMBL29660211 0.75 TP53 (0.43) HSD17B10TP53MAPTKDM4ETSHR
SCHEMBL17621014 0.73 RAB9A (0.41) HSD17B10TP53MAPTALDH1A1TSHR

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
JP-57149288-A — — None — — JP disclosed
JP-S57149288-A IMIDAZO(2,1-B)BENZOTHIAZOLE DERIVATIVE YAMANOUCHI PHARMACEUT CO LTD 1982-09-14 — — JP disclosed
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