SCHEMBL5853876

SCHEMBL5853876

Cc1cccc(C)c1C(=O)N[Hf](Cl)(Cl)(c1cccc2c1Cc1ccccc1-2)[SiH](c1ccccc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
TAS1R3 Q7RTX0 1/20 0.33
TAS1R1 Q7RTX1 1/20 0.33
TAS1R2 Q8TE23 1/20 0.33
HTR7 P34969 1/20 0.32
HTR2B P41595 1/20 0.32
DRD2 P14416 1/20 0.32
DRD4 P21917 1/20 0.32
DRD3 P35462 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MAPK1 P28482 1/20 0.31
HSP90AA1 P07900 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SLC6A9 P48067 2/20 0.30
MYC P01106 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL5853489 0.93 RAB9A (0.37) RAB9ANPC1HTR7HTR2BDRD2
SCHEMBL5853365 0.91 NPC1 (0.38) RAB9ANPC1HTR7HTR2BDRD2
SCHEMBL5853683 0.88 RAB9A (0.41) RAB9ANPC1TAS1R3TAS1R1TAS1R2
SCHEMBL5852959 0.87 NPC1 (0.39) RAB9ANPC1HTR7HTR2BDRD2
SCHEMBL5853621 0.87 RAB9A (0.37) RAB9ANPC1HTR7HTR2BDRD2
SCHEMBL5855903 0.86 NPC1 (0.48) RAB9ANPC1HTR7HTR2BDRD2
SCHEMBL5854356 0.86 RAB9A (0.37) RAB9ANPC1HTR7HTR2BDRD2
SCHEMBL5854033 0.85 SMN1; SMN2 (0.40) RAB9ANPC1MEN1KMT2A
SCHEMBL5853764 0.83 RAB9A (0.40) RAB9ANPC1HTR7HTR2BDRD2
SCHEMBL5853386 0.83 NPC1 (0.40) RAB9ANPC1HTR7HTR2BDRD2

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