SCHEMBL2024932

SCHEMBL2024932

OCCOCCc1csc(Br)c1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 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
SCHEMBL9404698 0.84 SLC6A2 (0.33) TSHRMAPK1MEN1KMT2ASLC6A2
SCHEMBL25092129 0.73 MAPK1 (0.42) TSHRMAPK1MEN1KMT2A
SCHEMBL8255507 0.72
SCHEMBL4670222 0.69 MEN1 (0.46) TSHRMAPK1MEN1KMT2A
SCHEMBL1749711 0.69
SCHEMBL2185705 0.68 TAAR1 (0.52)
SCHEMBL8606086 0.67 TAAR1 (0.48) TSHRMAPK1MEN1KMT2A
SCHEMBL24346534 0.65 MEN1 (0.35) TSHRMAPK1MEN1KMT2A
SCHEMBL1180141 0.65 TDP1 (0.58) TSHRMAPK1MEN1KMT2A
Di(Hydroxyethyl)Ether SCHEMBL16085977 0.65 TDP1 (0.58) TSHRMAPK1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8535571-B2 Water-soluble electrically conductive polymers KOREA UNIVERSITY RESEARCH AND BUSINESS FOUNDATION (KR) 2013-09-17 US disclosed
WO-2011081340-A1 WATER-SOLUBLE ELECTRICALLY CONDUCTIVE POLYMERS KOREA UNIVERSITY RESEARCH AND BUSINESS FOUNDATION (KR) 2011-07-07 WO disclosed
US-20110155963-A1 WATER-SOLUBLE ELECTRICALLY CONDUCTIVE POLYMERS KOREA UNIVERSITY RESEARCH AND BUSINESS FOUNDATION (KR) 2011-06-30 US disclosed