SCHEMBL10429653

SCHEMBL10429653

CCCCCCOc1c(Br)ccc(-c2ccccc2)c1F

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 1/20 0.49
PTPN1 P18031 2/20 0.45
THRA P10827 4/20 0.42
THRB P10828 4/20 0.42
PTPN11 Q06124 5/20 0.40
LTA4H P09960 1/20 0.40
HDAC8 Q9BY41 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALOX5AP P20292 1/20 0.36
FEN1 P39748 1/20 0.36

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
SCHEMBL10447508 1.00 SOAT1 (0.49) SOAT1PTPN1THRATHRBPTPN11
SCHEMBL9149250 0.86 SOAT1 (0.47) SOAT1PTPN1THRATHRBPTPN11
SCHEMBL9561559 0.79 SOAT1 (0.48) SOAT1PTPN1THRATHRBPTPN11
SCHEMBL5793269 0.78 THRA (0.51) THRATHRBLTA4H
SCHEMBL7789312 0.77 SOAT1 (0.49) SOAT1PTPN1THRATHRBPTPN11
SCHEMBL7926353 0.77 SOAT1 (0.50) SOAT1PTPN1PTPN11LTA4H
SCHEMBL10429752 0.76 FFAR1 (0.39) KDM4EALOX5APFEN1
SCHEMBL9495395 0.75 PTPN11 (0.46) SOAT1PTPN1THRATHRBPTPN11
SCHEMBL2957901 0.74 THRA (0.49) THRATHRBLTA4H
SCHEMBL2572575 0.74 THRA (0.49) THRATHRBLTA4H

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
EP-0360042-A1 p-Terphenyl derivatives and liquid crystalline compositions KANTO KAGAKU KABUSHIKI KAISHA (JP) 1990-03-28 EP disclosed