SCHEMBL6903266

SCHEMBL6903266

Cc1ccc(C2C([Zr]C3=Cc4c(-c5cccc6ccccc56)cccc4C3c3ccc(C)o3)=Cc3c(-c4cccc5ccccc45)cccc32)o1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.35
HPGD P15428 7/20 0.35
MAPT P10636 7/20 0.35
KDM4E B2RXH2 7/20 0.35
ALOX15 P16050 6/20 0.35
HSD17B10 Q99714 5/20 0.35
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
CASP1 P29466 3/20 0.35
HTT P42858 3/20 0.35
USP2 O75604 2/20 0.35
ALOX12 P18054 2/20 0.35
POLB P06746 1/20 0.35
BRCA1 P38398 1/20 0.35
RECQL P46063 1/20 0.35
HBB P68871 1/20 0.35
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
NPC1 O15118 3/20 0.32
GAA P10253 3/20 0.32

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
SCHEMBL6902049 0.84 ALDH1A1 (0.35) ALDH1A1HPGDMAPTKDM4EALOX15
SCHEMBL6904381 0.83 ALDH1A1 (0.32) ALDH1A1HPGDMAPTHSD17B10MEN1
Hydrochloric Acid SCHEMBL6904273 0.82 MEN1 (0.33) ALDH1A1HPGDMAPTKDM4EALOX15
SCHEMBL6903792 0.81 ALDH1A1 (0.32) ALDH1A1HPGDMAPTKDM4EALOX15
SCHEMBL6903054 0.78 MAPT (0.30) ALDH1A1HPGDMAPTKDM4EALOX15
SCHEMBL6902623 0.77 BRD4 (0.33)
SCHEMBL6898551 0.75 KDM4E (0.36) ALDH1A1HPGDMAPTKDM4EALOX15
SCHEMBL6902981 0.75 S1PR1 (0.31) ALDH1A1MAPTMEN1KMT2ANPSR1
SCHEMBL6901233 0.74 SLC6A2 (0.38) ALDH1A1HPGDMAPTKDM4EALOX15
SCHEMBL6903739 0.73 ALDH1A1 (0.39) ALDH1A1HPGDMAPTKDM4EALOX15

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-1033371-B1 Transition metal compound, catalyst system, process for the preparation thereof and its use for the polymerization of olefins BASELL POLYOLEFINE GMBH (DE) 2004-01-28 EP claimed