SCHEMBL14224276

SCHEMBL14224276

C=C(C)C(=O)ON1C(C)(C)CC(N(CCCC)C(C)=O)CC1(C)C

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 1/20 0.34
TSHR P16473 2/20 0.33
THRB P10828 1/20 0.32

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
SCHEMBL1138443 0.82 SRD5A1 (0.34) SRD5A1THRB
SCHEMBL9400312 0.82 TSHR (0.37) SRD5A1TSHRTHRB
SCHEMBL9440221 0.79 TSHR (0.40) TSHR
SCHEMBL308455 0.78 SRD5A1 (0.38) SRD5A1THRB
SCHEMBL25701748 0.74 HPGD (0.34) TSHR
SCHEMBL8459911 0.74 SRD5A1 (0.38) SRD5A1THRB
SCHEMBL14690061 0.71 L3MBTL1 (0.32) SRD5A1
SCHEMBL4417247 0.71 L3MBTL1 (0.35) SRD5A1THRB
SCHEMBL11140293 0.71 SRD5A1 (0.34) SRD5A1THRB
SCHEMBL2369739 0.69 KDM5A (0.33) SRD5A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7358365-B2 Process for the controlled increase in the molecular weight of polyethylenes CIBA SPECIALTY CHEMICALS CORPORATION (US) 2008-04-15 US disclosed