SCHEMBL8717997

SCHEMBL8717997

CCN(C(=O)c1ccccc1N1CCC(C(=O)c2ccc(F)cc2)CC1)c1cccc(N)c1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
HSD11B1 P28845 13/20 0.46
LMNA P02545 1/20 0.43
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 1/20 0.41
BLM P54132 1/20 0.41

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
SCHEMBL8714643 0.90 HSD11B1 (0.51) HTTTDP1HSD11B1LMNAKMT2A
SCHEMBL8712536 0.90 HTT (0.53) HTTTDP1HSD11B1LMNAKMT2A
SCHEMBL8714721 0.89 HTT (0.53) HTTTDP1HSD11B1LMNAKMT2A
SCHEMBL8716899 0.88 HTT (0.49) HTTTDP1HSD11B1LMNAKMT2A
SCHEMBL8712187 0.88 HSD11B1 (0.52) HTTTDP1HSD11B1LMNAKMT2A
SCHEMBL8712275 0.88 HSD11B1 (0.54) HTTTDP1HSD11B1LMNAKMT2A
SCHEMBL8718638 0.88 HTT (0.46) HTTTDP1HSD11B1LMNAKMT2A
Hydrochloric Acid SCHEMBL8715324 0.87 HSD11B1 (0.53) HTTTDP1HSD11B1LMNAKMT2A
SCHEMBL8715137 0.86 HSD11B1 (0.49) HTTTDP1HSD11B1LMNAKMT2A
SCHEMBL8716537 0.86 HSD11B1 (0.53) HTTTDP1HSD11B1LMNAKMT2A

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