SCHEMBL8930849

SCHEMBL8930849

CCCCCCCCCOc1ccc2c(ccc3cc(OCCCCCCC)ccc32)c1F

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.43
NR5A1 Q13285 1/20 0.42
PPM1A P35813 1/20 0.41
TSHR P16473 2/20 0.41
HTR1B P28222 1/20 0.39
MTNR1A P48039 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA3 P07451 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
CA5B Q9Y2D0 1/20 0.39
TP53 P04637 1/20 0.38

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
SCHEMBL8719604 1.00 THRA (0.43) THRANR5A1PPM1ATSHRHTR1B
SCHEMBL8723346 1.00 THRA (0.43) THRANR5A1PPM1ATSHRHTR1B
SCHEMBL8930882 1.00 THRA (0.43) THRANR5A1PPM1ATSHRHTR1B
SCHEMBL8930863 1.00 THRA (0.43) THRANR5A1PPM1ATSHRHTR1B
SCHEMBL8720756 1.00 THRA (0.43) THRANR5A1PPM1ATSHRHTR1B
SCHEMBL8720777 1.00 THRA (0.43) THRANR5A1PPM1ATSHRHTR1B
SCHEMBL8724390 1.00 THRA (0.43) THRANR5A1PPM1ATSHRHTR1B
SCHEMBL8930864 1.00 THRA (0.43) THRANR5A1PPM1ATSHRHTR1B
SCHEMBL8723072 1.00 THRA (0.43) THRANR5A1PPM1ATSHRHTR1B
SCHEMBL8719321 1.00 THRA (0.43) THRANR5A1PPM1ATSHRHTR1B

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
WO-1997004039-A1 FERROELECTRIC LIQUID CRYSTAL MIXTURE HOECHST RESEARCH & TECHNOLOGY DEUTSCHLAND GMBH & CO. KG (DE) 1997-02-06 WO disclosed