SCHEMBL5853489

SCHEMBL5853489

Cc1cc(C)c(C(=O)N[Hf](Cl)(Cl)(c2cccc3c2Cc2ccccc2-3)[SiH](c2ccccc2)c2ccccc2)c(C)c1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.37
NPC1 O15118 2/20 0.37
KDM4E B2RXH2 1/20 0.32
MAPK1 P28482 1/20 0.32
HSP90AA1 P07900 1/20 0.31
HTR2B P41595 2/20 0.31
HTR7 P34969 1/20 0.31
POLB P06746 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
DRD2 P14416 1/20 0.30
DRD4 P21917 1/20 0.30
DRD3 P35462 1/20 0.30
CYP1A2 P05177 1/20 0.30
ADRA2A P08913 1/20 0.30
MAOA P21397 1/20 0.30
SLC6A2 P23975 1/20 0.30
HTR2C P28335 1/20 0.30
SLC6A4 P31645 1/20 0.30
SRD5A2 P31213 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
SCHEMBL5853876 0.93 RAB9A (0.39) RAB9ANPC1KDM4EMAPK1HSP90AA1
SCHEMBL5854356 0.89 RAB9A (0.37) RAB9ANPC1KDM4EMAPK1HSP90AA1
SCHEMBL5853187 0.89 RAB9A (0.39) RAB9ANPC1KDM4EMAPK1HSP90AA1
SCHEMBL5854033 0.86 SMN1; SMN2 (0.40) RAB9ANPC1POLBSMN1; SMN2
SCHEMBL5853365 0.86 NPC1 (0.38) RAB9ANPC1HSP90AA1HTR2BHTR7
SCHEMBL5852959 0.84 NPC1 (0.39) RAB9ANPC1KDM4EHSP90AA1HTR2B
SCHEMBL5853621 0.84 RAB9A (0.37) RAB9ANPC1KDM4EMAPK1HTR2B
SCHEMBL5855903 0.83 NPC1 (0.48) RAB9ANPC1HSP90AA1HTR2BHTR7
SCHEMBL6830302 0.83 NPC1 (0.33) RAB9ANPC1
SCHEMBL5853683 0.81 RAB9A (0.41) RAB9ANPC1KDM4EMAPK1HSP90AA1

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