SCHEMBL7599701

SCHEMBL7599701

CC1=Cc2c(-c3cccc4ccccc34)cccc2C1[Hf](C)(C)(=[SiH2])(c1ccccc1)(c1ccccc1)C1C(C)=Cc2c(-c3cccc4ccccc34)cccc21

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 3/20 0.33
HTR1A P08908 2/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
ALOX15 P16050 1/20 0.32
CA12 O43570 3/20 0.30
CA1 P00915 3/20 0.30
CA2 P00918 3/20 0.30
CA9 Q16790 3/20 0.30
KDM4E B2RXH2 2/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 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
SCHEMBL7598826 0.90 HTR7 (0.33) HTR7HTR1AMAOAMAOBALOX15
SCHEMBL7601524 0.85 HTR7 (0.34) HTR7HTR1AKDM4E
SCHEMBL797634 0.84 HTR7 (0.34) HTR7HTR1AALOX15KDM4E
SCHEMBL796346 0.81 CNR2 (0.32) HTR7ALOX15
SCHEMBL30229819 0.74 ALDH1A1 (0.37) HTR7HTR1AMAOAMAOBALOX15
SCHEMBL5860453 0.74 ALDH1A1 (0.37) HTR7HTR1AMAOAMAOBALOX15
SCHEMBL17952999 0.74 ALDH1A1 (0.37) HTR7HTR1AMAOAMAOBCA12
SCHEMBL7603244 0.74 PDCD1 (0.30) HTR7HTR1A
SCHEMBL7996888 0.73 ALDH1A1 (0.36) HTR7HTR1AMAOAMAOBALOX15
SCHEMBL7252936 0.73 ALDH1A1 (0.36) HTR7HTR1AMAOAMAOBALOX15

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
US-6410665-B1 POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN BASELL POLYOLEFINE GMBH (DE) 2002-06-25 US claimed
US-6410665-B1 POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN BASELL POLYOLEFINE GMBH (DE) 2002-06-25 US disclosed