SCHEMBL5855407

SCHEMBL5855407

CC(C)(C)c1cccc(C(=O)N[Hf](Cl)(Cl)(C2C=Cc3ccccc32)[SiH](c2ccccc2)c2ccccc2)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.36
HDAC8 Q9BY41 3/20 0.36
HDAC6 Q9UBN7 2/20 0.36
ACHE P22303 3/20 0.34
KCNK9 Q9NPC2 1/20 0.34
CTSL P07711 2/20 0.33
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
LMNA P02545 2/20 0.32
BRAF P15056 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GLA P06280 1/20 0.31
MAPK1 P28482 1/20 0.31
CASP3 P42574 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL5854465 0.89 HDAC8 (0.38) NR1H4HDAC8HDAC6ACHEKCNK9
SCHEMBL5853370 0.87 SMN1; SMN2 (0.41) HDAC8HDAC6KCNK9LMNAMEN1
SCHEMBL5854316 0.87 ATM (0.32) HDAC8HDAC6LMNAMEN1KMT2A
SCHEMBL5852971 0.83 POLB (0.33) LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL5856051 0.81 ITGB1 (0.31)
SCHEMBL5853065 0.80 ALDH1A1 (0.30) ALDH1A1
SCHEMBL5855377 0.80 TAS1R3 (0.34)
SCHEMBL5853704 0.79
SCHEMBL5855544 0.78 KMT2A (0.32) KMT2A
SCHEMBL5853111 0.78 HPGD (0.36) KCNK9MEN1KMT2ASMN1; SMN2NPC1

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