SCHEMBL5854736

SCHEMBL5854736

CC(C)c1cccc(C(C)C)c1C(=O)N[Zr](Cl)(Cl)(c1cccc2c1Cc1ccccc1-2)[SiH](C)C

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
EGFR P00533 1/20 0.32
HTR7 P34969 1/20 0.32
HTR2B P41595 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MAPK1 P28482 1/20 0.31
LMNA P02545 1/20 0.31
KMT2A Q03164 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
SCHEMBL5852890 0.92 RAB9A (0.39) RAB9ANPC1EGFRHTR7HTR2B
SCHEMBL5853467 0.89 RAB9A (0.37) RAB9ANPC1EGFRHTR7HTR2B
SCHEMBL5854568 0.86 RAB9A (0.41) RAB9ANPC1HTR7HTR2BKDM4E
SCHEMBL5854947 0.84 RAB9A (0.42) RAB9ANPC1HTR7HTR2BKDM4E
SCHEMBL5853358 0.83 RAB9A (0.39) RAB9ANPC1HTR7HTR2BKDM4E
SCHEMBL5855207 0.82 RAB9A (0.51) RAB9ANPC1HTR7HTR2BKDM4E
SCHEMBL5853793 0.82 RAB9A (0.37) RAB9ANPC1EGFRHTR7HTR2B
SCHEMBL5853077 0.81 NPC1 (0.40) RAB9ANPC1HTR7HTR2BKMT2A
SCHEMBL5852815 0.80 RAB9A (0.39) RAB9ANPC1HTR7HTR2BKDM4E
SCHEMBL5852904 0.79 NPC1 (0.42) RAB9ANPC1HTR7HTR2BKMT2A

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