SCHEMBL7107902

SCHEMBL7107902

C[SiH](C1=C(c2cccc3ccccc23)[CH]c2ccccc21)C1=C(c2cccc3ccccc23)[CH]c2ccccc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP3 O14638 1/20 0.35
ENPP1 P22413 1/20 0.35
PPARG P37231 4/20 0.35
PPARA Q07869 4/20 0.35
ALDH1A1 P00352 2/20 0.34
CYP3A4 P08684 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
KEAP1 Q14145 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CYP2A6 P11509 1/20 0.34
POLB P06746 1/20 0.34
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
DHFR P00374 1/20 0.33
ALOX15 P16050 2/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33

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
SCHEMBL218375 0.77 ALDH1A1 (0.42) ENPP3ENPP1ALDH1A1CYP3A4HPGD
SCHEMBL215411 0.73 CHRNB4 (0.37) PPARGPPARAALDH1A1CYP3A4HPGD
SCHEMBL216444 0.71 CNR1 (0.35) PPARGPPARAALDH1A1CYP3A4HPGD
SCHEMBL2958680 0.69 CNR1 (0.39) ALOX15GAA
SCHEMBL2971768 0.69 ALDH1A1 (0.46) ENPP3ENPP1ALDH1A1CYP3A4HPGD
SCHEMBL2963519 0.68 CNR1 (0.43) MAPTALOX15
SCHEMBL216214 0.67 ALDH1A1 (0.41) ALDH1A1CYP3A4HPGDTSHRKEAP1
SCHEMBL2967708 0.67 CNR1 (0.44) ALDH1A1HPGDNPC1MAPTRAB9A
SCHEMBL2975165 0.67 CNR1 (0.44) ALDH1A1HPGDNPC1MAPTRAB9A
SCHEMBL2964841 0.67 CNR1 (0.44) ALDH1A1HPGDNPC1MAPTRAB9A

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-1053263-B1 CATALYST SYSTEM BASELL POLYOLEFINE GMBH (DE) 2003-10-01 EP claimed