SCHEMBL7997809

SCHEMBL7997809

Cc1c(Cl)ccnc1Cn1cnc2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 8/20 0.57
CYP11B2 P19099 8/20 0.57
LMNA P02545 5/20 0.57
HTT P42858 4/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
TNF P01375 2/20 0.55
MAPK1 P28482 2/20 0.55
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
ALDH1A1 P00352 2/20 0.50
TDP1 Q9NUW8 1/20 0.49
PKM P14618 1/20 0.48
TSHR P16473 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
GAA P10253 1/20 0.46
RAB9A P51151 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
SCHEMBL7983841 0.80 SMN1; SMN2 (0.50) CYP11B1CYP11B2LMNAHTTSMN1; SMN2
Hydrochloric Acid SCHEMBL8001463 0.79 SMN1; SMN2 (0.49) CYP11B1CYP11B2LMNAHTTSMN1; SMN2
SCHEMBL2513699 0.78 CYP11B1 (0.49) CYP11B1CYP11B2LMNAHTTSMN1; SMN2
SCHEMBL7983835 0.77 SMN1; SMN2 (0.47) CYP11B1CYP11B2LMNAHTTSMN1; SMN2
SCHEMBL7994647 0.76 SMN1; SMN2 (0.49) CYP11B1CYP11B2LMNAHTTSMN1; SMN2
SCHEMBL7983909 0.76 SMN1; SMN2 (0.49) CYP11B1CYP11B2LMNAHTTSMN1; SMN2
SCHEMBL7995844 0.75 SMN1; SMN2 (0.48) CYP11B1CYP11B2LMNAHTTSMN1; SMN2
SCHEMBL7983724 0.75 SMN1; SMN2 (0.55) CYP11B1CYP11B2LMNAHTTSMN1; SMN2
SCHEMBL30310275 0.74 MAPK1 (0.69) CYP11B1CYP11B2LMNAHTTSMN1; SMN2
SCHEMBL28975960 0.74 MAPK1 (0.69) CYP11B1CYP11B2LMNAHTTSMN1; SMN2

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
WO-2001034578-A1 COMPOUNDS WITH ANTI-HELICOBACTER PYLORI ACTIVITY ASTRAZENECA AB (SE) 2001-05-17 WO disclosed