SCHEMBL7232091

SCHEMBL7232091

CN(C(=O)c1cn2c(nc3ccc([N+](=O)[O-])cc32)s1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.47
LMNA P02545 5/20 0.41
RAB9A P51151 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
POLB P06746 1/20 0.41
AHR P35869 1/20 0.41
CASP6 P55212 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 5/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
MAPT P10636 5/20 0.40
NPC1 O15118 1/20 0.40
NPBWR1 P48145 1/20 0.40
MCHR1 Q99705 1/20 0.40
GAA P10253 1/20 0.39
MAPK1 P28482 1/20 0.39
TOP1 P11387 2/20 0.39
GRM1 Q13255 3/20 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
SCHEMBL7232156 0.82 LMNA (0.44) LMNARAB9AMEN1KMT2APOLB
Hydrochloric Acid SCHEMBL7235507 0.82 MAPT (0.42) LMNARAB9AKMT2AALDH1A1SMN1; SMN2
SCHEMBL6904603 0.81 ATM (0.46) ATMLMNARAB9AMEN1KMT2A
Hydrochloric Acid SCHEMBL7240261 0.80 GRM1 (0.47) LMNARAB9AALDH1A1SMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL7233122 0.80 GRM1 (0.46) LMNARAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL7232085 0.79 GRM1 (0.61) LMNARAB9AMEN1KMT2APOLB
SCHEMBL6907716 0.78 GRM1 (0.49) LMNARAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL6907720 0.78 GRM1 (0.49) LMNARAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL7238022 0.77 NPC1 (0.42) LMNARAB9AALDH1A1SMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL7234112 0.76 NPC1 (0.42) LMNARAB9AALDH1A1SMN1; SMN2MAPT

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
US-6642264-B1 Thiazolo(3,2-a)benzoimidazole derivatives act specifically on metabotropic glutamate receptors and are used as medicaments. YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 2003-11-04 US disclosed
EP-1167369-A1 NOVEL THIAZOLOBENZIMIDAZOLE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2002-01-02 EP disclosed