SCHEMBL14636127

SCHEMBL14636127

CCCCCCCCCCCCCCCCc1ccccc1Br

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.58
TAAR1 Q96RJ0 3/20 0.52
NR1H2 P55055 1/20 0.47
NR1H3 Q13133 1/20 0.47
BID P55957 3/20 0.45
MCL1 Q07820 3/20 0.45
BCL2L1 Q07817 2/20 0.45
BAK1 Q16611 2/20 0.45
KAT8 Q9H7Z6 2/20 0.45
PPARG P37231 1/20 0.45
PPARA Q07869 1/20 0.45
EP300 Q09472 1/20 0.45
KAT2A Q92830 1/20 0.45
KAT2B Q92831 1/20 0.45
KAT5 Q92993 1/20 0.45
SAE1 Q9UBE0 1/20 0.45
THRA P10827 1/20 0.44
THRB P10828 1/20 0.44
KCNH2 Q12809 1/20 0.44
RECQL P46063 1/20 0.44

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
SCHEMBL10383680 1.00 LIPG (0.58) LIPGTAAR1NR1H2NR1H3BID
SCHEMBL8766460 1.00 LIPG (0.58) LIPGTAAR1NR1H2NR1H3BID
SCHEMBL5599119 1.00 LIPG (0.58) LIPGTAAR1NR1H2NR1H3BID
SCHEMBL31591865 1.00 LIPG (0.58) LIPGTAAR1NR1H2NR1H3BID
SCHEMBL9835429 1.00 LIPG (0.58) LIPGTAAR1NR1H2NR1H3BID
SCHEMBL27574851 1.00 LIPG (0.58) LIPGTAAR1NR1H2NR1H3BID
SCHEMBL28299135 1.00 LIPG (0.58) LIPGTAAR1NR1H2NR1H3BID
SCHEMBL31591893 1.00 LIPG (0.58) LIPGTAAR1NR1H2NR1H3BID
SCHEMBL6153468 1.00 LIPG (0.58) LIPGTAAR1NR1H2NR1H3BID
SCHEMBL5599418 1.00 LIPG (0.58) LIPGTAAR1NR1H2NR1H3BID

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9761805-B2 Organic semiconductors MERCK PATENT GMBH (DE) 2017-09-12 US disclosed
EP-2734528-B1 ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2017-03-29 EP disclosed
CN-103649096-B Organic semiconductor 默克专利股份有限公司 2016-12-07 CN disclosed
US-20140158949-A1 ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2014-06-12 US disclosed
EP-2734528-A2 ORGANIC SEMICONDUCTORS Merck Patent GmbH (DE) 2014-05-28 EP disclosed
CN-103649096-A Organic semiconductors MERCK PATENT GMBH 2014-03-19 CN disclosed
WO-2013010614-A2 ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2013-01-24 WO disclosed
CN-1086903-A Measure the borax reagent of human body hemoglobin STAFF AND WORKERS HOSPITAL SHA (CN) 1994-05-18 CN disclosed
CN-1086903-A Measure the borax reagent of human body hemoglobin STAFF AND WORKERS HOSPITAL SHA (CN) 1994-05-18 CN disclosed