SCHEMBL9207476

SCHEMBL9207476

Cc1cc2c(cc1C)CC(=O)N(CC1CCCN(CCc3csc4cc(Br)ccc34)C1)CC2

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.33
UTS2R Q9UKP6 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CXCR4 P61073 1/20 0.31
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30

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
SCHEMBL9217178 0.92 HCN4 (0.39) HTR1AMEN1KMT2AMAOAMAOB
SCHEMBL9215882 0.91 LTA4H (0.32) HTR1AUTS2RMEN1KMT2A
SCHEMBL9211495 0.90 HTR1A (0.42) HTR1AUTS2RMEN1KMT2ACXCR4
SCHEMBL9205646 0.89 MEN1 (0.40) MEN1KMT2AMAOAMAOB
SCHEMBL9215232 0.87 HTR1A (0.40) HTR1AUTS2RMEN1KMT2ACXCR4
SCHEMBL9213910 0.87 HCN4 (0.40) HTR1AMEN1KMT2A
SCHEMBL9216931 0.85 ACHE (0.36) HTR1AMEN1KMT2AMAOAMAOB
SCHEMBL9206494 0.84 MTNR1A (0.41) HTR1AUTS2RMEN1KMT2A
SCHEMBL9205651 0.84 HTR1A (0.38) HTR1AUTS2R
SCHEMBL9214402 0.84 HTR1A (0.37) HTR1AUTS2R

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0292840-B1 Cyclic amine derivatives, medicaments containing these compounds and procedure for their preparation THOMAE GMBH DR K (DE) 1995-08-09 EP disclosed
US-5175157-A Cardiovascular disorders BOEHRINGER INGELHEIM GMBH (DE) 1992-12-29 US disclosed