SCHEMBL7730196

SCHEMBL7730196

C1=C(c2ccco2)Cc2cccc(-c3ccccc3)c21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMARCA2 P51531 1/20 0.38
PBRM1 Q86U86 1/20 0.38
ALDH1A1 P00352 4/20 0.36
KDM4E B2RXH2 4/20 0.36
HSD17B10 Q99714 4/20 0.36
HPGD P15428 3/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
CASP1 P29466 2/20 0.36
PIK3R1 P27986 1/20 0.36
PIK3CA P42336 1/20 0.36
MEN1 O00255 1/20 0.36
USP2 O75604 1/20 0.36
ESR1 P03372 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
ALOX15 P16050 1/20 0.36
MAPK1 P28482 1/20 0.36
BLM P54132 1/20 0.36

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
SCHEMBL6056293 0.81 PRCP (0.42) ALDH1A1HSD17B10HPGDMAPK1HTR1A
SCHEMBL7172757 0.81 PRCP (0.39) ALDH1A1HSD17B10HPGDMAPK1HTR1A
SCHEMBL29672903 0.81 PRCP (0.39) ALDH1A1HSD17B10HPGDMAPK1HTR1A
Hydrochloric Acid SCHEMBL27988524 0.78 PRCP (0.40) HTR1AHTR7
Hydrochloric Acid SCHEMBL31539915 0.78 PRCP (0.37) ALDH1A1HSD17B10HPGDMAPK1HTR1A
Hydrochloric Acid SCHEMBL7175465 0.78 PRCP (0.37) ALDH1A1HSD17B10HPGDMAPK1HTR1A
SCHEMBL15827724 0.77 PTGS1 (0.37) ALDH1A1KDM4EHSD17B10HPGDNPC1
SCHEMBL2973446 0.77 PIK3R1 (0.36) ALDH1A1KDM4EHSD17B10HPGDNPC1
SCHEMBL27988523 0.75 PRCP (0.38) HTR1AHTR7
SCHEMBL28239564 0.75 PRCP (0.35) HTR1AHTR7

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-6479646-B1 Metallocene compounds having indenyl ligand and catalysts for olefin polymerization containing the same CHISSO CORPORATION (JP) 2002-11-12 US disclosed