SCHEMBL5853003

SCHEMBL5853003

C[SiH](C)[Hf](Cl)(Cl)(NC(=O)C1CCCCCCCCCCC1)C1C=Cc2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.37
CYP2C19 P33261 1/20 0.36
P2RX7 Q99572 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
CETP P11597 1/20 0.34
HDAC3 O15379 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
LMNA P02545 1/20 0.33
OPRM1 P35372 1/20 0.33
GAA P10253 2/20 0.33
ALDH1A1 P00352 2/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
KDM4E B2RXH2 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL5855247 1.00 HPGD (0.37) HPGDCYP2C19P2RX7SMN1; SMN2CETP
SCHEMBL5854342 0.99 HPGD (0.35) HPGDCYP2C19P2RX7SMN1; SMN2CETP
SCHEMBL5853040 0.87 HPGD (0.39) HPGDCYP2C19SMN1; SMN2CETPHDAC3
SCHEMBL5852841 0.87 HPGD (0.39) HPGDCYP2C19SMN1; SMN2CETPHDAC3
SCHEMBL5853854 0.85 HPGD (0.36) HPGDCYP2C19SMN1; SMN2CETPHDAC3
SCHEMBL6278425 0.82 P2RX7 (0.38) HPGDCYP2C19P2RX7SMN1; SMN2CETP
SCHEMBL5854290 0.82
SCHEMBL5853277 0.79
SCHEMBL5853982 0.79 MEN1 (0.33) SMN1; SMN2HDAC3HDAC1HDAC2LMNA
SCHEMBL5852586 0.79 SMN1; SMN2 (0.31) CYP2C19SMN1; SMN2

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