SCHEMBL5855252

SCHEMBL5855252

CCCCC(=O)N[Ti](Cl)(Cl)(c1cccc2c1Cc1ccccc1-2)[SiH](c1ccccc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
GAA P10253 2/20 0.38
LMNA P02545 1/20 0.38
SOAT1 P35610 2/20 0.37
DRD2 P14416 1/20 0.35
DRD4 P21917 1/20 0.35
DRD3 P35462 1/20 0.35
TSHR P16473 1/20 0.35
NAMPT P43490 2/20 0.35
ALDH1A1 P00352 2/20 0.35
EPHX2 P34913 1/20 0.34
ALOX15 P16050 1/20 0.34
MAPK1 P28482 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
LTB4R2 Q9NPC1 1/20 0.34
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 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
SCHEMBL5854762 0.97 LMNA (0.41) NPC1RAB9AGAALMNASOAT1
SCHEMBL5853037 0.97 LMNA (0.41) NPC1RAB9AGAALMNASOAT1
SCHEMBL5856508 0.97 LMNA (0.41) NPC1RAB9AGAALMNASOAT1
SCHEMBL5853227 0.94 NPC1 (0.42) NPC1RAB9AGAALMNADRD2
SCHEMBL5853562 0.90 RAB9A (0.41) NPC1RAB9AGAALMNADRD2
SCHEMBL5853459 0.89 NPC1 (0.40) NPC1RAB9AGAALMNASOAT1
SCHEMBL5853949 0.86 GAA (0.43) NPC1RAB9AGAALMNASOAT1
SCHEMBL5854088 0.86 GAA (0.43) NPC1RAB9AGAALMNASOAT1
SCHEMBL5855017 0.86 GAA (0.43) NPC1RAB9AGAALMNASOAT1
SCHEMBL5853736 0.85 MEN1 (0.40) NPC1RAB9ALMNADRD2DRD4

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
US-7037989-B2 Copolymers of ethylene and/or α-olefins and vicinally disubstituted olefins EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-05-02 US disclosed
WO-2004106394-A1 COPOLYMERS OF ETHYLENE AND/OR α-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-12-09 WO disclosed
US-20040242814-A1 COPOLYMERS OF ETHYLENE AND/OR ALPHA-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-02 US disclosed