SCHEMBL9683173

SCHEMBL9683173

CCCCCCOc1ccc(Br)c(Br)c1Br

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.45
THRB P10828 1/20 0.45
SMPD1 P17405 4/20 0.42
PTPN11 Q06124 4/20 0.42
S1PR3 Q99500 2/20 0.42
NR5A1 Q13285 1/20 0.42
MEN1 O00255 1/20 0.41
NR1I2 O75469 1/20 0.41
LMNA P02545 1/20 0.41
CHRM2 P08172 1/20 0.41
CYP3A4 P08684 1/20 0.41
ADRA2A P08913 1/20 0.41
MAPT P10636 1/20 0.41
OPRK1 P41145 1/20 0.41
HTR2B P41595 1/20 0.41
SLC6A3 Q01959 1/20 0.41
KMT2A Q03164 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
S1PR2 O95136 1/20 0.41
S1PR1 P21453 1/20 0.41

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
SCHEMBL9685134 1.00 THRA (0.45) THRATHRBSMPD1PTPN11S1PR3
SCHEMBL9684798 1.00 THRA (0.45) THRATHRBSMPD1PTPN11S1PR3
SCHEMBL8109088 0.98 THRA (0.43) THRATHRBSMPD1PTPN11S1PR3
SCHEMBL9685182 0.92 CYP1A2 (0.44) THRATHRBNR5A1MEN1LMNA
SCHEMBL11406541 0.88 F2 (0.39) MEN1LMNAMAPTKMT2AALDH1A1
SCHEMBL11398711 0.86 HPGD (0.44) MEN1LMNAMAPTKMT2AALDH1A1
SCHEMBL9751184 0.86 MEN1 (0.39) THRATHRBMEN1CYP3A4MAPT
SCHEMBL9751191 0.86 MEN1 (0.39) THRATHRBMEN1CYP3A4MAPT
SCHEMBL9751169 0.86 MEN1 (0.39) THRATHRBMEN1CYP3A4MAPT
SCHEMBL15391585 0.86 THRA (0.44) THRATHRBSMPD1PTPN11S1PR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5106522-A Liquid hydrophobic vehicle for electro-rheological fluid NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1992-04-21 US claimed
EP-0150994-B1 ELECTRO-RHEOLOGICAL FLUID COMPOSITIONS NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1987-11-19 EP claimed
EP-0150994-A1 Electro-rheological fluid compositions NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1985-08-07 EP claimed
US-5106522-A Liquid hydrophobic vehicle for electro-rheological fluid NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1992-04-21 US disclosed
EP-0150994-B1 ELECTRO-RHEOLOGICAL FLUID COMPOSITIONS NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1987-11-19 EP disclosed
EP-0150994-A1 Electro-rheological fluid compositions NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1985-08-07 EP disclosed