SCHEMBL10698219

SCHEMBL10698219

COC(=O)c1cc2nc(SCc3ccccc3N(C)C)[nH]c2cc1OC

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.49
PRMT5 O14744 12/20 0.49
WDR77 Q9BQA1 11/20 0.49
LMNA P02545 4/20 0.48
RAB9A P51151 4/20 0.48
NPC1 O15118 3/20 0.48
HTT P42858 2/20 0.48
RECQL P46063 1/20 0.46
GAA P10253 1/20 0.45
TSHR P16473 1/20 0.45
ALDH1A1 P00352 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL9678554 0.87 SMN1; SMN2 (0.58) SMN1; SMN2PRMT5WDR77LMNARAB9A
SCHEMBL10701057 0.85 SMN1; SMN2 (0.54) SMN1; SMN2PRMT5WDR77LMNARAB9A
SCHEMBL10697968 0.84 SMN1; SMN2 (0.53) SMN1; SMN2PRMT5WDR77LMNARAB9A
SCHEMBL9676691 0.83 RAB9A (0.58) SMN1; SMN2PRMT5WDR77LMNARAB9A
SCHEMBL6475746 0.82 SMN1; SMN2 (0.51) SMN1; SMN2PRMT5WDR77LMNARAB9A
SCHEMBL10700628 0.80 PRMT5 (0.36) SMN1; SMN2PRMT5WDR77LMNARAB9A
SCHEMBL10699314 0.80 SMN1; SMN2 (0.50) SMN1; SMN2PRMT5WDR77RAB9AHTT
SCHEMBL10710732 0.80 SMN1; SMN2 (0.50) SMN1; SMN2PRMT5WDR77LMNARAB9A
SCHEMBL10699503 0.79 PTGS2 (0.49) SMN1; SMN2PRMT5WDR77LMNARAB9A
SCHEMBL10700126 0.78 SMN1; SMN2 (0.45) SMN1; SMN2PRMT5WDR77LMNARAB9A

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