SCHEMBL429157

SCHEMBL429157

C=CC[Sn](Cl)(CC=C)CCCCC

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.41
ALDH1A1 P00352 1/20 0.39
THRB P10828 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
SCHEMBL29180766 0.88 TSHR (0.40) TSHRALDH1A1
SCHEMBL2465249 0.77 TSHR (0.44) TSHRALDH1A1THRB
SCHEMBL3639103 0.76 TSHR (0.44) TSHRALDH1A1THRB
SCHEMBL347984 0.75 TSHR (0.50) TSHRALDH1A1THRB
SCHEMBL11607008 0.75 TSHR (0.50) TSHRALDH1A1THRB
SCHEMBL733440 0.75 TSHR (0.50) TSHRALDH1A1THRB
SCHEMBL11337147 0.75 TSHR (0.50) TSHRALDH1A1THRB
SCHEMBL8541402 0.75 TSHR (0.50) TSHRALDH1A1THRB
SCHEMBL27452615 0.75 TSHR (0.50) TSHRALDH1A1THRB
SCHEMBL11696941 0.75 TSHR (0.50) TSHRALDH1A1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8101786-B2 Energy efficient synthesis of boranes LOS ALAMOS NATIONAL SECURITY, LLC (US) 2012-01-24 US disclosed
US-20110105706-A1 ENERGY EFFICIENT SYNTHESIS OF BORANES LOS ALAMOS NATIONAL SECURITY, LLC (US) 2011-05-05 US disclosed
US-7837852-B2 Energy efficient synthesis of boranes LOS ALAMOS NATIONAL SECURITY, LLC (US) 2010-11-23 US disclosed
US-20090297423-A1 ENERGY EFFICIENT SYNTHESIS OF BORANES LOS ALAMOS NATIONAL SECURITY, LLC (US) 2009-12-03 US disclosed
EP-1984406-A2 ENERGY EFFICIENT SYNTHESIS OF BORANES Los Alamos National Security, LLC (US) 2008-10-29 EP disclosed
WO-2007092601-A2 ENERGY EFFICIENT SYNTHESIS OF BORANES LOS ALAMOS NATIONAL SECURITY, LLC (US) 2007-08-16 WO disclosed
US-20070189950-A1 Energy efficient synthesis of boranes LOS ALAMOS NATIONAL SECURITY, LLC 2007-08-16 US disclosed