SCHEMBL10702170

SCHEMBL10702170

CCOc1cc2nc([S+]([O-])C(C)c3ccccc3N(CC)CC)[nH]c2cc1OCC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.38
LMNA P02545 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
RAB9A P51151 2/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
USP2 O75604 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TP53 P04637 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
NPSR1 Q6W5P4 1/20 0.35
SYK P43405 1/20 0.34
ITK Q08881 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
SCHEMBL10698492 0.80 LMNA (0.36) MAPTLMNASMN1; SMN2RAB9AKDM4E
SCHEMBL10702572 0.80 PDE10A (0.36) KDM4EF10L3MBTL1POLB
SCHEMBL10700069 0.78 LMNA (0.42) MAPTLMNASMN1; SMN2RAB9AKDM4E
SCHEMBL10701035 0.77 LMNA (0.40) MAPTLMNASMN1; SMN2RAB9AKDM4E
SCHEMBL10700412 0.76 PLG (0.34) MAPTLMNASMN1; SMN2RAB9AKDM4E
SCHEMBL10700413 0.73 OGT (0.36) MAPTLMNASMN1; SMN2RAB9AKDM4E
SCHEMBL10702652 0.73 OGT (0.37) MAPTLMNASMN1; SMN2RAB9AKDM4E
SCHEMBL10702722 0.73 ACHE (0.35) MAPTLMNASMN1; SMN2RAB9AKDM4E
SCHEMBL9676124 0.71 ATP4A (0.40) LMNASMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL10701690 0.71 PRMT5 (0.36) MAPTLMNASMN1; SMN2RAB9AKDM4E

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-0251536-A1 Benzimidazoles, their production, formulation and use as gastric acid secretion inhibitors FISONS plc (GB) 1988-01-07 EP claimed
EP-0251536-A1 Benzimidazoles, their production, formulation and use as gastric acid secretion inhibitors FISONS plc (GB) 1988-01-07 EP disclosed