SCHEMBL8714136

SCHEMBL8714136

CCN(C(=O)c1ccc(CN2C(=O)c3ccccc3C2=O)cc1N1CCC(C(=O)c2ccc(F)cc2)CC1)c1ccccc1OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.43
LMNA P02545 2/20 0.43
KMT2A Q03164 2/20 0.43
DRD2 P14416 2/20 0.43
HTR2A P28223 2/20 0.43
HTR2C P28335 2/20 0.43
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42
HTT P42858 5/20 0.42
TDP1 Q9NUW8 1/20 0.42
MAPT P10636 2/20 0.41
ABCB1 P08183 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.41
HSD17B10 Q99714 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ADRA1D P25100 1/20 0.40
ADRA1A P35348 1/20 0.40
ADRA1B P35368 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MEN1 O00255 1/20 0.39

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
SCHEMBL8713520 0.92 HSD11B1 (0.44) HSD11B1LMNAKMT2ADRD2HTR2A
SCHEMBL8712332 0.89 HSD11B1 (0.48) HSD11B1LMNAKMT2ADRD2HTR2A
SCHEMBL8712650 0.88 HSD11B1 (0.47) HSD11B1LMNAKMT2ADRD2HTR2A
SCHEMBL8717660 0.87 HSD11B1 (0.49) HSD11B1LMNAKMT2ADRD2HTR2A
SCHEMBL8715832 0.87 HSD11B1 (0.47) HSD11B1LMNAKMT2ADRD2HTR2A
SCHEMBL8712078 0.87 HSD11B1 (0.43) HSD11B1LMNAKMT2ADRD2HTR2A
SCHEMBL8711959 0.85 RXFP1 (0.42) HSD11B1LMNAKMT2ADRD2HTR2A
SCHEMBL8716384 0.84 HSD11B1 (0.44) HSD11B1LMNAKMT2ADRD2HTR2A
SCHEMBL8711620 0.84 HSD11B1 (0.56) HSD11B1LMNAKMT2ADRD2HTR2A
SCHEMBL8712108 0.82 HSD11B1 (0.45) HSD11B1LMNAKMT2ADRD2HTR2A

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
US-5728835-A HYPOTENSIVE AGENTS; ANTIISCHEMIC AGENTS TOA EIYO, LTD. (JP) 1998-03-17 US disclosed