SCHEMBL5853241

SCHEMBL5853241

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

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.40
LMNA P02545 2/20 0.40
NPC1 O15118 4/20 0.39
RAB9A P51151 4/20 0.39
SOAT1 P35610 2/20 0.37
NAMPT P43490 3/20 0.37
P2RX7 Q99572 1/20 0.36
EPHX2 P34913 1/20 0.35
POLB P06746 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALOX15 P16050 1/20 0.35
MAPK1 P28482 1/20 0.35
HSD17B10 Q99714 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.33
CETP P11597 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL5854187 0.99 GAA (0.42) GAALMNANPC1RAB9ASOAT1
SCHEMBL5854675 0.99 GAA (0.42) GAALMNANPC1RAB9ASOAT1
SCHEMBL5855484 0.97 NPC1 (0.40) GAALMNANPC1RAB9ASOAT1
SCHEMBL5854441 0.92 NPC1 (0.44) GAALMNANPC1RAB9AMEN1
SCHEMBL5853766 0.89 RAB9A (0.42) LMNANPC1RAB9ANAMPTMEN1
SCHEMBL5853085 0.89 GAA (0.39) GAALMNANPC1RAB9ASOAT1
SCHEMBL5854135 0.88 GAA (0.40) GAALMNANPC1RAB9ASOAT1
SCHEMBL5854769 0.88 GAA (0.40) GAALMNANPC1RAB9ASOAT1
SCHEMBL5853999 0.85 NPC1 (0.38) GAALMNANPC1RAB9ASOAT1
SCHEMBL5855207 0.83 RAB9A (0.51) LMNANPC1RAB9AMEN1KMT2A

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