SCHEMBL4698419

SCHEMBL4698419

CCC1=Cc2c(cccc2P(c2ccccc2)c2ccccc2)C1CC1C(C)=Cc2c(Br)cccc21

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 2/20 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
SCHEMBL1453522 0.92 TOP1 (0.35) TOP1
SCHEMBL1452427 0.85 TOP1 (0.35) TOP1
SCHEMBL1451702 0.79 GABRA1 (0.31)
SCHEMBL1453718 0.79 TOP1 (0.38) TOP1
SCHEMBL1451774 0.77 PBRM1 (0.32)
SCHEMBL1452585 0.75 TOP1 (0.30) TOP1
SCHEMBL1453022 0.75 DRD1 (0.33) TOP1
SCHEMBL1452233 0.72 HTR2A (0.37)
SCHEMBL1453017 0.72 HTR2A (0.32)
SCHEMBL1454523 0.72 TOP1 (0.38) TOP1

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-1971621-A1 PREPARATION OF SUBSTITUTED BRIDGED INDENYL AND RELATED LIGANDS ExxonMobil Chemical Patents Inc. (US) 2008-09-24 EP disclosed
WO-2007070045-A1 PREPARATION OF SUBSTITUTED BRIDGED INDENYL AND RELATED LIGANDS EXXONMOBIL CHEMICAL PATENTS, INC. (US) 2007-06-21 WO disclosed