SCHEMBL5855486

SCHEMBL5855486

C[SiH](C)[Hf](Cl)(Cl)(NC(=O)C(C)(C)C)c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
HTR2B P41595 2/20 0.35
HTR7 P34969 1/20 0.35
MAPT P10636 1/20 0.33
PNMT P11086 1/20 0.33
CYP1A2 P05177 1/20 0.32
ADRA2A P08913 1/20 0.32
MAOA P21397 1/20 0.32
SLC6A2 P23975 1/20 0.32
HTR2C P28335 1/20 0.32
SLC6A4 P31645 1/20 0.32
LCK P06239 1/20 0.32
CTSL P07711 1/20 0.32
PTPRC P08575 1/20 0.32
PTPN2 P17706 1/20 0.32
PTPN1 P18031 1/20 0.32
CTSS P25774 1/20 0.32
PTPN13 Q12923 1/20 0.32
HSP90AA1 P07900 1/20 0.31

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
SCHEMBL5853386 0.88 NPC1 (0.40) NPC1RAB9AHTR2BHTR7MAPT
SCHEMBL5853400 0.87 RAB9A (0.51) NPC1RAB9AHTR2BHTR7PNMT
SCHEMBL5854944 0.84 RAB9A (0.42) NPC1RAB9AHTR2BHTR7MAPT
SCHEMBL5853476 0.84 RAB9A (0.42) NPC1RAB9AHTR2BHTR7MAPT
SCHEMBL5853604 0.83 NPC1 (0.38) NPC1RAB9AHTR2BHTR7MAPT
SCHEMBL5853840 0.83 NPC1 (0.44) NPC1RAB9AHTR2BHTR7PNMT
SCHEMBL5853683 0.82 RAB9A (0.41) NPC1RAB9AHTR2BHTR7MAPT
SCHEMBL7210057 0.82 NPC1 (0.38) NPC1RAB9AHTR2BHTR7PNMT
SCHEMBL5854995 0.81 MAPK14 (0.38) NPC1RAB9ACTSLMEN1KMT2A
SCHEMBL5852745 0.81 NPC1 (0.40) NPC1RAB9AHTR2BHTR7MAPT

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 2 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
US-20040242814-A1 COPOLYMERS OF ETHYLENE AND/OR ALPHA-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-02 US disclosed