SCHEMBL5890264

SCHEMBL5890264

CCC(=O)NB(NC(=O)CC)[Hf](Cl)(Cl)(C1C(C(C)CC)=Cc2c(-c3ccccc3-c3cccc4ccccc34)cccc21)C1C(C(C)CC)=Cc2c(-c3ccccc3-c3cccc4ccccc34)cccc21

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 1/20 0.31
PPARG P37231 1/20 0.31
PPARA Q07869 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
ALOX5 P09917 1/20 0.30

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
SCHEMBL5890517 0.93 MEN1 (0.31) MEN1KMT2AALOX5
SCHEMBL5891235 0.88
SCHEMBL5891088 0.88
SCHEMBL5890591 0.88
SCHEMBL5890532 0.87 SMN1; SMN2 (0.30)
SCHEMBL5890469 0.86
SCHEMBL5889947 0.86
SCHEMBL5889716 0.86
SCHEMBL5890049 0.86 MEN1 (0.32) MEN1KMT2AALOX5
SCHEMBL5890367 0.85

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7122498-B2 Metallocenes and catalyst compositions derived therefrom EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-10-17 US disclosed