SCHEMBL5721772

SCHEMBL5721772

CCc1ccc2c(c1-c1cc(C)cc(C)c1)C=C(c1ccccc1)[CH]2

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TP53 P04637 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAPT P10636 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
SCHEMBL5721762 0.90 MAPT (0.30) MAPT
SCHEMBL5721760 0.82 CNR1 (0.37) TP53MAPT
SCHEMBL5721381 0.82 METAP2 (0.33)
SCHEMBL5721400 0.81 HEXA (0.33)
SCHEMBL5721818 0.81 HEXA (0.33) KDM4ETP53L3MBTL1
SCHEMBL5721411 0.81 PTGS2 (0.32)
SCHEMBL5721234 0.81 TRPA1 (0.33)
SCHEMBL5721826 0.76 PDCD1 (0.33) TP53L3MBTL1
SCHEMBL5721244 0.74 DPP4 (0.33)
SCHEMBL5721691 0.74

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
EP-1640377-A1 Metallocenes and catalyst compositions derived therefrom Exxonmobil Chemical Patents Inc. (US) 2006-03-29 EP disclosed