SCHEMBL17565201

SCHEMBL17565201

CCCCCCCCOc1cc(C)c(OCCO)c(C(C)(C)c2cc(OCCCCCCCC)cc(C(C)(C)C)c2OCCO)c1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.39
THRA P10827 2/20 0.39
PLA2G2A P14555 1/20 0.38
CNR1 P21554 9/20 0.38
CNR2 P34972 8/20 0.38
TP53 P04637 1/20 0.37
MAPK1 P28482 1/20 0.37
PTPN11 Q06124 1/20 0.36
NR5A1 Q13285 1/20 0.35

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
SCHEMBL17565193 0.72 HTR1A (0.46)
SCHEMBL1086609 0.72 CA1 (0.52) PLA2G2ACNR1CNR2TP53NR5A1
SCHEMBL9999756 0.72 CA1 (0.52) PLA2G2ACNR1CNR2TP53NR5A1
SCHEMBL6693439 0.72 CA1 (0.52) PLA2G2ACNR1CNR2TP53NR5A1
SCHEMBL8768660 0.71 CYP3A4 (0.39) MAPK1
SCHEMBL17565213 0.70 HTR1A (0.39) MAPK1
SCHEMBL20328579 0.70 NR5A1 (0.49) THRBTHRATP53NR5A1
SCHEMBL14594240 0.70 RXRA (0.47) THRBTHRANR5A1
SCHEMBL28234757 0.70 THRA (0.39) THRBTHRAPLA2G2ANR5A1
SCHEMBL7042602 0.69 CYP3A4 (0.38) NR5A1

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
US-20160071992-A1 BACK SHEET FOR SOLAR CELLS AND SOLAR CELL MODULE FUJIFILM CORPORATION (JP) 2016-03-10 US disclosed