SCHEMBL5855017

SCHEMBL5855017

CCCCCC(=O)N[Ti](Cl)(Cl)(c1cccc2c1Cc1ccccc1-2)[SiH](C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.43
LMNA P02545 1/20 0.43
SOAT1 P35610 3/20 0.40
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
NAMPT P43490 2/20 0.39
EPHX2 P34913 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
P2RX7 Q99572 1/20 0.36
CETP P11597 1/20 0.36
ASAH1 Q13510 2/20 0.35
SOAT2 O75908 1/20 0.35
POLB P06746 1/20 0.35
EP300 Q09472 1/20 0.34
ALDH1A1 P00352 1/20 0.34
ACER2 Q5QJU3 1/20 0.34
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34

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
SCHEMBL5853949 1.00 GAA (0.43) GAALMNASOAT1NPC1RAB9A
SCHEMBL5854088 1.00 GAA (0.43) GAALMNASOAT1NPC1RAB9A
SCHEMBL5853459 0.97 NPC1 (0.40) GAALMNASOAT1NPC1RAB9A
SCHEMBL5854802 0.92 NPC1 (0.44) GAALMNANPC1RAB9AMEN1
SCHEMBL5854762 0.90 LMNA (0.41) GAALMNASOAT1NPC1RAB9A
SCHEMBL5856508 0.90 LMNA (0.41) GAALMNASOAT1NPC1RAB9A
SCHEMBL5853037 0.90 LMNA (0.41) GAALMNASOAT1NPC1RAB9A
SCHEMBL5853480 0.89 RAB9A (0.42) GAALMNANPC1RAB9ANAMPT
SCHEMBL5855252 0.86 NPC1 (0.39) GAALMNASOAT1NPC1RAB9A
SCHEMBL5853920 0.85 L3MBTL1 (0.40) GAALMNANPC1RAB9AMEN1

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