SCHEMBL6613554

SCHEMBL6613554

CC(C)Oc1ccc(Cl)c(CC2CCN(CC3CC(=O)N(Cc4ccccc4)C(=O)N3)CC2)c1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 5/20 0.49
SLC6A4 P31645 5/20 0.49
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP2D6 P10635 1/20 0.40
POLB P06746 1/20 0.40
ATM Q13315 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
HRH1 P35367 5/20 0.38
CCR3 P51677 5/20 0.38
KCNH2 Q12809 3/20 0.38
MAOB P27338 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37

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
SCHEMBL6615902 0.91 HTR1A (0.48) HTR1ASLC6A4MEN1KMT2AALDH1A1
SCHEMBL6612859 0.91 HTR1A (0.60) HTR1ASLC6A4MEN1KMT2AALDH1A1
SCHEMBL6615657 0.89 HTR1A (0.49) HTR1ASLC6A4MEN1KMT2AALDH1A1
SCHEMBL6615132 0.87 HTR1A (0.45) HTR1ASLC6A4CYP2D6FFAR4HRH1
SCHEMBL6416499 0.86 HTR1A (0.50) HTR1ASLC6A4MEN1KMT2AALDH1A1
SCHEMBL6412520 0.86 HTR1A (0.50) HTR1ASLC6A4MEN1KMT2AALDH1A1
SCHEMBL6613622 0.86 ALDH1A1 (0.45) HTR1ASLC6A4MEN1KMT2AALDH1A1
SCHEMBL6614951 0.85 HTR1A (0.51) HTR1ASLC6A4MEN1KMT2AALDH1A1
SCHEMBL6616444 0.84 ALDH1A1 (0.44) HTR1ASLC6A4MEN1KMT2AALDH1A1
SCHEMBL6615246 0.83 HTR1A (0.51) HTR1ASLC6A4MEN1KMT2AALDH1A1

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-1466901-A1 SEROTONINE REUPTAKE INHIBITOR SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2004-10-13 EP disclosed