SCHEMBL9149889

SCHEMBL9149889

CCCCCCCCOc1ccc(-c2ccc(O)cc2)cc1Cl

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.53
PTPN11 Q06124 4/20 0.51
THRA P10827 1/20 0.50
THRB P10828 1/20 0.50
PTPN1 P18031 1/20 0.48
PTPN6 P29350 1/20 0.48
S1PR1 P21453 2/20 0.46
LTA4H P09960 1/20 0.46
S1PR2 O95136 1/20 0.46
S1PR3 Q99500 1/20 0.46
LPAR2 Q9HBW0 1/20 0.46
ATM Q13315 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
GLA P06280 1/20 0.46
MEN1 O00255 1/20 0.45
NPC1 O15118 1/20 0.45
TP53 P04637 1/20 0.45
HPGD P15428 1/20 0.45
TSHR P16473 1/20 0.45
RAB9A P51151 1/20 0.45

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
SCHEMBL9398890 0.91 THRA (0.53) PTPN11THRATHRBPTPN1PTPN6
SCHEMBL9399929 0.91 THRA (0.53) PTPN11THRATHRBPTPN1PTPN6
SCHEMBL9647635 0.88 THRA (0.54) NR5A1THRATHRBS1PR1LTA4H
SCHEMBL9698883 0.88 THRA (0.54) NR5A1THRATHRBS1PR1LTA4H
SCHEMBL9734720 0.88 THRA (0.54) NR5A1THRATHRBS1PR1LTA4H
SCHEMBL9698942 0.88 THRA (0.54) NR5A1THRATHRBS1PR1LTA4H
SCHEMBL10979314 0.87 MAPT (0.51) PTPN11THRATHRBPTPN1PTPN6
SCHEMBL10975554 0.87 MAPT (0.51) PTPN11THRATHRBPTPN1PTPN6
SCHEMBL10984612 0.87 MAPT (0.51) PTPN11THRATHRBPTPN1PTPN6
SCHEMBL10979303 0.87 MAPT (0.51) PTPN11THRATHRBPTPN1PTPN6

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-5397504-A Liquid crystal KANTO KAGAKU KABUSHIKI KAISHA (JP) 1995-03-14 US disclosed
EP-0315701-B1 BIPHENYL COMPOUND KANTO KAGAKU (JP) 1993-12-29 EP disclosed
EP-0315701-A1 BIPHENYL COMPOUND KANTO KAGAKU KABUSHIKI KAISHA (JP) 1989-05-17 EP disclosed