SCHEMBL5890104

SCHEMBL5890104

CC(C)C1=Cc2c(-c3ccccc3-c3cccc4ccccc34)cccc2C1[Zr](Cl)(Cl)(C1C(C(C)C)=Cc2c(-c3ccccc3-c3cccc4ccccc34)cccc21)[SiH](C)C

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALOX5 P09917 1/20 0.30
PTPN1 P18031 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
SCHEMBL2513908 0.99 NPC1 (0.34) NPC1MAPTRAB9ASMN1; SMN2ALOX5
SCHEMBL273550 0.93 NPC1 (0.31) NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL28806583 0.90 ALDH1A1 (0.31)
SCHEMBL5890634 0.89 NPC1 (0.31) NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL5584026 0.87
SCHEMBL1026090 0.87
SCHEMBL1022253 0.86
SCHEMBL1023601 0.86
SCHEMBL1024768 0.86
SCHEMBL5890345 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