SCHEMBL9544065

SCHEMBL9544065

CCOC(CCCCBr)OCC

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.35
LMNA P02545 1/20 0.33

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
SCHEMBL28325095 0.98 THRB (0.33) THRBLMNA
SCHEMBL29992494 0.98 THRB (0.33) THRBLMNA
SCHEMBL10375027 0.98 THRB (0.33) THRBLMNA
SCHEMBL19305257 0.98 THRB (0.33) THRBLMNA
SCHEMBL3993550 0.98 THRB (0.33) THRBLMNA
SCHEMBL6915938 0.92 THRB (0.36) THRBLMNA
SCHEMBL7753817 0.87 THRB (0.44) THRBLMNA
SCHEMBL7928503 0.84 THRB (0.42) THRBLMNA
SCHEMBL8431364 0.84 THRB (0.42) THRBLMNA
SCHEMBL7937409 0.84 THRB (0.42) THRBLMNA

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
WO-1993008195-A1 CYCLIC PEROXYACETAL COMPOUNDS THE UNIVERSITY OF SYDNEY (AU) 1993-04-29 WO disclosed
US-4894391-A Novel prostacyclin derivatives, process for the preparation thereof, and use thereof as medicinal agents SCHERING AKTIENGESELLSCHAFT (DE) 1990-01-16 US disclosed