SCHEMBL5852802

SCHEMBL5852802

CCCCC(CC)C(=O)N[Hf](Cl)(Cl)(C1C=Cc2ccccc21)[SiH](C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TSHR P16473 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CA1 P00915 4/20 0.36
CA2 P00918 4/20 0.36
LMNA P02545 1/20 0.35
CA7 P43166 1/20 0.35
CA14 Q9ULX7 1/20 0.35
HDAC8 Q9BY41 5/20 0.34
HDAC3 O15379 3/20 0.34
HDAC6 Q9UBN7 3/20 0.34
HDAC1 Q13547 2/20 0.34
HDAC2 Q92769 2/20 0.34
HDAC4 P56524 1/20 0.34
HDAC7 Q8WUI4 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
SCHEMBL5855014 0.89 MAPK1 (0.41) MEN1ALDH1A1MAPTMAPK1KMT2A
SCHEMBL5855507 0.82 NPC1 (0.37) MEN1ALDH1A1MAPK1KMT2ASMN1; SMN2
SCHEMBL5852903 0.81 CETP (0.39) MEN1ALDH1A1MAPK1KMT2ASMN1; SMN2
SCHEMBL5853905 0.81 CETP (0.39) MEN1ALDH1A1MAPK1KMT2ASMN1; SMN2
SCHEMBL5853662 0.80 MAPK1 (0.35) MEN1ALDH1A1MAPTMAPK1KMT2A
SCHEMBL5852586 0.80 SMN1; SMN2 (0.31) MEN1MAPK1KMT2ASMN1; SMN2TSHR
SCHEMBL5854290 0.78
SCHEMBL5853277 0.78
SCHEMBL5853982 0.75 MEN1 (0.33) MEN1ALDH1A1MAPTMAPK1KMT2A
SCHEMBL5853722 0.74 MEN1 (0.40) MEN1ALDH1A1MAPTMAPK1KMT2A

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