SCHEMBL5852997

SCHEMBL5852997

CCCC(=O)N[Zr](Cl)(Cl)(c1cccc2c1Cc1ccccc1-2)[SiH](c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.44
NPC1 O15118 4/20 0.44
ALOX5 P09917 1/20 0.38
ALDH1A1 P00352 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
LMNA P02545 1/20 0.35
THRA P10827 1/20 0.35
THRB P10828 1/20 0.35
MAPT P10636 2/20 0.34
HPGD P15428 1/20 0.34
TDP2 O95551 1/20 0.33
PAX8 Q06710 1/20 0.33
HKDC1 Q2TB90 1/20 0.33
TLR9 Q9NR96 1/20 0.33
CYP2C19 P33261 1/20 0.33
RECQL P46063 1/20 0.33
PTPRC P08575 2/20 0.33
HTR2B P41595 2/20 0.33
MTNR1A P48039 1/20 0.33

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
SCHEMBL5853999 0.94 NPC1 (0.38) RAB9ANPC1ALDH1A1LMNAPKM
SCHEMBL5853085 0.93 GAA (0.39) RAB9ANPC1MEN1KMT2ALMNA
SCHEMBL5853420 0.93 RAB9A (0.40) RAB9ANPC1ALOX5ALDH1A1MEN1
SCHEMBL5854135 0.92 GAA (0.40) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL5854769 0.92 GAA (0.40) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL5854441 0.88 NPC1 (0.44) RAB9ANPC1ALOX5ALDH1A1MEN1
SCHEMBL5855645 0.87 RAB9A (0.48) RAB9ANPC1ALDH1A1HTR2BMTNR1A
SCHEMBL5856940 0.84 RAB9A (0.40) RAB9ANPC1LMNAMAPTPTPRC
SCHEMBL5852571 0.84 NPC1 (0.39) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL5853569 0.83 MEN1 (0.43) RAB9ANPC1ALDH1A1MEN1KMT2A

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