SCHEMBL1983259

SCHEMBL1983259

Cc1ccc(C2=Cc3ccccc3C2[Ti](Cl)Cl)cc1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
NFKB1 P19838 1/20 0.33
RAB9A P51151 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL4068964 0.88
SCHEMBL1981936 0.84 PTAFR (0.33) NPC1RAB9AL3MBTL1ALDH1A1
SCHEMBL1980941 0.81 KIF11 (0.41) POLBRAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL3760664 0.77
SCHEMBL8673496 0.75 NPC1 (0.33) HPGDNPC1POLBNFKB1RAB9A
SCHEMBL27618424 0.74 EDNRB (0.33) HPGDNPC1POLBNFKB1RAB9A
SCHEMBL394873 0.73 L3MBTL1 (0.30) HPGDL3MBTL1KDM4EMEN1ALDH1A1
SCHEMBL6287249 0.73 RGS4 (0.31) HPGDL3MBTL1KDM4EMEN1ALDH1A1
SCHEMBL7031934 0.72 NPC1 (0.31) HPGDNPC1POLBNFKB1RAB9A
Hydrochloric Acid SCHEMBL1983257 0.72 PRCP (0.33) HPGDNPC1POLBNFKB1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011074688-A1 PRODUCTION PROCESS OF OLEFIN POLYMERIZATION CATALYST AND OLEFIN POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-06-23 WO disclosed
US-20050256282-A1 Process for producing contact product; catalyst component for addition polymerization; process for producing catalyst for addition polymerization; and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED 2005-11-17 US disclosed
US-20030069127-A1 Modified particle,support, catalyst component for addition polymerization, catalyst for addition polymerization, and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMTED (JP) 2003-04-10 US disclosed