SCHEMBL5722174

SCHEMBL5722174

CC(C)(C)c1nc2cc(CNS(=O)(=O)c3ccccc3)ccc2n1Cc1ccncc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 17/20 0.54
LMNA P02545 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
MAPT P10636 1/20 0.48
THRB P10828 1/20 0.48
RECQL P46063 1/20 0.48
KMT2A Q03164 1/20 0.48
CNR2 P34972 1/20 0.46

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
SCHEMBL5722182 0.82 CNR2 (0.69) CNR2
SCHEMBL5722233 0.80 CNR2 (0.59) GNRHRMEN1ALDH1A1MAPTTHRB
SCHEMBL5722219 0.79 CNR2 (0.65) CNR2
SCHEMBL4965783 0.78 F2 (0.46) CNR2
SCHEMBL4967696 0.71 F2 (0.48) ALDH1A1CNR2
SCHEMBL4662893 0.71 SMN1; SMN2 (1.00) LMNASMN1; SMN2ALDH1A1
SCHEMBL5722234 0.71 CNR2 (0.58) CNR2
SCHEMBL5521048 0.69 CNR2 (0.62) CNR2
SCHEMBL30075090 0.69 ALDH1A1 (0.59) GNRHRLMNASMN1; SMN2MEN1ALDH1A1
SCHEMBL5722202 0.69 CNR2 (0.57) CNR2

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-1673369-A1 BENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM, PREPARATION THEREOF AND USES THEREOF AstraZeneca AB (SE) 2006-06-28 EP disclosed
WO-2005030761-A1 BENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM, PREPARATION THEREOF AND USES THEREOF ASTRAZENECA AB (SE) 2005-04-07 WO disclosed