SCHEMBL5854342

SCHEMBL5854342

C[SiH](C)[Hf](Cl)(Cl)(NC(=O)C1CCCC1)C1C=Cc2ccccc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.35
CYP2C19 P33261 1/20 0.34
LMNA P02545 1/20 0.34
P2RX7 Q99572 2/20 0.34
NPSR1 Q6W5P4 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HSD17B10 Q99714 1/20 0.33
KMT2A Q03164 1/20 0.33
RECQL P46063 1/20 0.33
CETP P11597 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
OPRM1 P35372 2/20 0.32
ADORA3 P0DMS8 1/20 0.32
ADORA2A P29274 1/20 0.32
ADORA1 P30542 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL5853003 0.99 HPGD (0.37) HPGDCYP2C19LMNAP2RX7NPSR1
SCHEMBL5855247 0.99 HPGD (0.37) HPGDCYP2C19LMNAP2RX7NPSR1
SCHEMBL5853854 0.86 HPGD (0.36) HPGDCYP2C19LMNASMN1; SMN2ALDH1A1
SCHEMBL5853040 0.85 HPGD (0.39) HPGDCYP2C19LMNASMN1; SMN2ALDH1A1
SCHEMBL5852841 0.85 HPGD (0.39) HPGDCYP2C19LMNASMN1; SMN2ALDH1A1
SCHEMBL5854290 0.83
SCHEMBL6278425 0.81 P2RX7 (0.38) HPGDCYP2C19LMNAP2RX7NPSR1
SCHEMBL5853277 0.80
SCHEMBL5852586 0.80 SMN1; SMN2 (0.31) CYP2C19SMN1; SMN2KMT2A
SCHEMBL5853982 0.80 MEN1 (0.33) LMNASMN1; SMN2ALDH1A1HSD17B10KMT2A

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 2 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
US-20040242814-A1 COPOLYMERS OF ETHYLENE AND/OR ALPHA-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-02 US disclosed