SCHEMBL8676158

SCHEMBL8676158

Cc1ccc([N+](=O)[O-])cc1N1C(=O)C(N(C)C(=O)C(N)CS)N=C(c2ccccc2)c2cc(Cl)ccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 1/20 0.40
PDE4D Q08499 1/20 0.40
LMNA P02545 2/20 0.39
OPRK1 P41145 1/20 0.39
PDE3A Q14432 1/20 0.39
BRD4 O60885 2/20 0.39
BRD2 P25440 2/20 0.39
BRD3 Q15059 2/20 0.39
FNTA P49354 1/20 0.36
FNTB P49356 1/20 0.36
CCKBR P32239 4/20 0.36
CCKAR P32238 2/20 0.36
NOTCH1 P46531 1/20 0.35
RBPJ Q06330 1/20 0.35
TP53 P04637 2/20 0.34
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MAPT P10636 1/20 0.33
KCNH2 Q12809 1/20 0.33

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
SCHEMBL8670552 0.92 HTR2B (0.45) HTR2BPDE4DLMNAOPRK1PDE3A
SCHEMBL8674320 0.90 HTR2B (0.43) HTR2BPDE4DLMNAOPRK1PDE3A
SCHEMBL8670539 0.89 HTR2B (0.42) HTR2BPDE4DLMNAOPRK1PDE3A
SCHEMBL8667947 0.88 HTR2B (0.42) HTR2BPDE4DLMNAOPRK1PDE3A
SCHEMBL8674199 0.86 HTR2B (0.41) HTR2BPDE4DLMNAOPRK1PDE3A
SCHEMBL8674481 0.86 HTR2B (0.45) HTR2BPDE4DLMNAOPRK1PDE3A
SCHEMBL8672013 0.85 HTR2B (0.42) HTR2BPDE4DLMNAOPRK1PDE3A
SCHEMBL8676256 0.85 HTR2B (0.43) HTR2BPDE4DLMNAOPRK1PDE3A
SCHEMBL8676161 0.85 BRD4 (0.42) HTR2BPDE4DLMNAOPRK1PDE3A
SCHEMBL8674515 0.84 HTR2B (0.39) HTR2BPDE4DLMNAOPRK1PDE3A

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-5843941-A Ras farnesyl transferase inhibitors GENENTECH, INC. (US) 1998-12-01 US disclosed