SCHEMBL10697738

SCHEMBL10697738

CC1C(=O)N(CCO)c2cc3[nH]c(-c4ccc(O)cc4)nc3cc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCD O00767 1/20 0.42
GUSB P08236 2/20 0.41
TOP1 P11387 2/20 0.41
TOP2A P11388 2/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NPBWR1 P48145 1/20 0.40
ADORA2A P29274 2/20 0.38
ADORA2B P29275 2/20 0.38
DGAT1 O75907 1/20 0.38
KCNH2 Q12809 1/20 0.38
CHEK1 O14757 1/20 0.38
PRKD3 O94806 1/20 0.38
PAK4 O96013 1/20 0.38
PDGFRA P16234 1/20 0.38
LTK P29376 1/20 0.38
MAP2K2 P36507 1/20 0.38
MAPK8 P45983 1/20 0.38

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
SCHEMBL10698129 0.90 KDM4E (0.43) SCDGUSBALDH1A1HPGDSMN1; SMN2
SCHEMBL10698629 0.89 SCD (0.43) SCDGUSBTOP1TOP2AALDH1A1
SCHEMBL10698622 0.89 SCD (0.40) SCDGUSBTOP1TOP2AALDH1A1
SCHEMBL10699596 0.89 SLC2A1 (0.46) GUSBALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL10696182 0.86 SCD (0.46) SCDGUSBTOP1TOP2AALDH1A1
SCHEMBL10701672 0.84 MAPT (0.48) GUSBALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL10530476 0.81 GUSB (0.41) SCDGUSBTOP1TOP2AALDH1A1
SCHEMBL10700922 0.81 CBFB (0.52) ALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL10700351 0.79 SLC2A1 (0.46) GUSBALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL10698685 0.78 DHODH (0.39) ALDH1A1HSD17B10CHEK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0268178-A1 Pyrrolo-benzimidazoles, medicaments containing these compounds and process for their preparation Dr. Karl Thomae GmbH (DE) 1988-05-25 EP disclosed