SCHEMBL8055646

SCHEMBL8055646

NC(=O)Cc1csc(S)n1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GABRA5 P31644 1/20 0.46
GABRB2 P47870 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CSNK2A1 P68400 1/20 0.39
ALDH1A1 P00352 4/20 0.37
LMNA P02545 2/20 0.37
RAB9A P51151 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
KDM4E B2RXH2 2/20 0.36
TP53 P04637 1/20 0.36
HTT P42858 1/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 2/20 0.35
NPC1 O15118 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
GAA P10253 1/20 0.34
HPGD P15428 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
SCHEMBL2411987 0.82 HSD17B10 (0.61) GABRA5GABRB2HSD17B10ALDH1A1LMNA
SCHEMBL8055620 0.81 HDAC1 (0.37) GABRA5GABRB2HSD17B10
SCHEMBL8056581 0.81 MEN1 (0.39) GABRA5GABRB2HSD17B10ALDH1A1LMNA
SCHEMBL2895259 0.78 GABRA5 (0.47) GABRA5GABRB2HSD17B10CSNK2A1ALDH1A1
SCHEMBL1797901 0.78 GABRA5 (0.72) GABRA5GABRB2HSD17B10ALDH1A1LMNA
SCHEMBL10431345 0.77 GABRA5 (0.46) GABRA5GABRB2HSD17B10CSNK2A1ALDH1A1
SCHEMBL2745279 0.77 GABRA5 (0.46) GABRA5GABRB2HSD17B10CSNK2A1ALDH1A1
SCHEMBL5544014 0.77 SMN1; SMN2 (0.57) GABRA5GABRB2HSD17B10ALDH1A1LMNA
SCHEMBL7746931 0.77 KDM4E (0.40) GABRA5GABRB2HSD17B10ALDH1A1SMN1; SMN2
SCHEMBL8055597 0.77 MEN1 (0.44) GABRA5GABRB2HSD17B10ALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6150351-A ADMINISTERING AN EFFECTIVE AMOUNT OF THE CEPHEM COMPOUND TO A PATIENT SUFFERING FROM DISEASES CAUSED BY HELICOBACTER PYLORI FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-11-21 US disclosed
EP-0882052-A1 NEW CEPHEM COMPOUNDS AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-12-09 EP disclosed
WO-1997029111-A1 NEW CEPHEM COMPOUNDS AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-08-14 WO disclosed