SCHEMBL3697332

SCHEMBL3697332

CC1=Cc2ccccc2C1(Br)Br

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
TSHR P16473 1/20 0.38
ALOX12 P18054 1/20 0.38
ACHE P22303 1/20 0.38

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
SCHEMBL2047468 0.74 PDK2 (0.34) LMNATSHRALOX12ACHE
SCHEMBL28815299 0.73 PDK2 (0.33) LMNATSHRALOX12ACHE
Ammonia Solution, Strong SCHEMBL7083566 0.73 PDK2 (0.33) LMNATSHRALOX12ACHE
SCHEMBL4652584 0.71 LMNA (0.31) LMNATSHRALOX12ACHE
SCHEMBL22616659 0.71 LMNA (0.31) LMNATSHRALOX12ACHE
SCHEMBL1675908 0.71 HTR2A (0.31) LMNATSHRALOX12ACHE
SCHEMBL19981021 0.71 LMNA (0.31) LMNATSHRALOX12ACHE
SCHEMBL28830003 0.71 LMNA (0.31) LMNATSHRALOX12ACHE
SCHEMBL6351669 0.71 PGR (0.31) LMNATSHRALOX12ACHE
SCHEMBL7941719 0.71 PDK2 (0.33) LMNATSHRALOX12ACHE

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
EP-2203486-A1 RACEMOSELECTIVE SYNTHESIS OF ANSA-METALLOCENE COMPOUNDS, ANSA-METALLOCENE COMPOUNDS, CATALYSTS COMPRISING THEM, PROCESS FOR PRODUCING AN OLEFIN POLYMER BY USE OF THE CATALYSTS, AND OLEFIN HOMO- AND COPOLYMERS Lummus Novolen Technology Gmbh (DE) 2010-07-07 EP disclosed
WO-2009054831-A1 RACEMOSELECTIVE SYNTHESIS OF ANSA-METALLOCENE COMPOUNDS, ANSA-METALLOCENE COMPOUNDS, CATALYSTS COMPRISING THEM, PROCESS FOR PRODUCING AN OLEFIN POLYMER BY USE OF THE CATALYSTS, AND OLEFIN HOMO- AND COPOLYMERS NOVOLEN TECHNOLOGY HOLDINGS, C.V. (NL) 2009-04-30 WO disclosed