SCHEMBL5602767

SCHEMBL5602767

Cl[Hf](Cl)(C1C(n2ncc3ccccc32)=Cc2ccccc21)C1C(n2ncc3ccccc32)=Cc2ccccc21

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.35
GAA P10253 1/20 0.35
SI P14410 1/20 0.35
MGAM2 Q2M2H8 1/20 0.35
RECQL P46063 1/20 0.34
LRRK2 Q5S007 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
PDE10A Q9Y233 3/20 0.32
MAPK8 P45983 1/20 0.31
MAPK9 P45984 1/20 0.31
MAPK10 P53779 1/20 0.31
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL5603041 0.78 RECQL (0.34) MGAMGAASIMGAM2RECQL
SCHEMBL5604112 0.78 RECQL (0.34) MGAMGAASIMGAM2RECQL
Hydrochloric Acid SCHEMBL5603035 0.77 LRRK2 (0.36) MGAMGAASIMGAM2RECQL
Hydrochloric Acid SCHEMBL5604106 0.77 LRRK2 (0.36) MGAMGAASIMGAM2RECQL
Hydrochloric Acid SCHEMBL5602758 0.77 LRRK2 (0.36) MGAMGAASIMGAM2RECQL
SCHEMBL5603604 0.76 SMN1; SMN2 (0.40) GAALMNARAB9ASMN1; SMN2
SCHEMBL5603165 0.75 BIRC5 (0.40)
SCHEMBL5599790 0.74 KDM4E (0.36) KDM4E
SCHEMBL5602569 0.74
SCHEMBL5602542 0.73 MAPT (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US disclosed
EP-1735354-A1 HETEROCYCLIC SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION Exxonmobil Chemical Company Inc. (US) 2006-12-27 EP disclosed
US-20050261449-A1 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENT INC. 2005-11-24 US disclosed
WO-2005105864-A1 HETEROCYCLIC SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2005-11-10 WO disclosed