SCHEMBL5854944

SCHEMBL5854944

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.42
NPC1 O15118 2/20 0.42
PNMT P11086 1/20 0.35
HTR2B P41595 2/20 0.35
HTR7 P34969 1/20 0.35
MTNR1A P48039 4/20 0.33
MTNR1B P49286 4/20 0.33
CYP1A2 P05177 2/20 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
SMN1; SMN2 Q16637 2/20 0.32
DRD2 P14416 2/20 0.32
DRD4 P21917 2/20 0.32
DRD3 P35462 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32

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
SCHEMBL5853840 0.92 NPC1 (0.44) RAB9ANPC1PNMTHTR2BHTR7
SCHEMBL5855396 0.90 NPC1 (0.40) RAB9ANPC1PNMTHTR2BHTR7
SCHEMBL5852956 0.89 GAA (0.40) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL5853773 0.88 GAA (0.42) RAB9ANPC1MEN1KMT2ANAMPT
SCHEMBL5852875 0.88 GAA (0.42) RAB9ANPC1MEN1KMT2ANAMPT
SCHEMBL5853764 0.88 RAB9A (0.40) RAB9ANPC1PNMTHTR2BHTR7
SCHEMBL5853400 0.87 RAB9A (0.51) RAB9ANPC1PNMTHTR2BHTR7
SCHEMBL5853476 0.84 RAB9A (0.42) RAB9ANPC1PNMTHTR2BHTR7
SCHEMBL5855486 0.84 NPC1 (0.42) RAB9ANPC1PNMTHTR2BHTR7
SCHEMBL5853683 0.82 RAB9A (0.41) RAB9ANPC1PNMTHTR2BHTR7

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