SCHEMBL9876446

SCHEMBL9876446

CCCCCCCCCCc1ccccc1OP(Oc1ccccc1)Oc1ccccc1CCCCCCCCCC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.52
THRB P10828 1/20 0.52
PPARA Q07869 3/20 0.47
LIPG Q9Y5X9 1/20 0.46
ALOX5 P09917 1/20 0.45
PTGS2 P35354 1/20 0.45
PPARG P37231 2/20 0.45
NR1H2 P55055 1/20 0.42
NR1H3 Q13133 1/20 0.42
TSHR P16473 1/20 0.42
BID P55957 3/20 0.40
MCL1 Q07820 3/20 0.40
BCL2L1 Q07817 2/20 0.40
BAK1 Q16611 2/20 0.40
KAT8 Q9H7Z6 2/20 0.40
EP300 Q09472 1/20 0.40
KAT2A Q92830 1/20 0.40
KAT2B Q92831 1/20 0.40
KAT5 Q92993 1/20 0.40
SAE1 Q9UBE0 1/20 0.40

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
SCHEMBL11142021 1.00 THRA (0.52) THRATHRBPPARALIPGALOX5
SCHEMBL1100666 1.00 THRA (0.52) THRATHRBPPARALIPGALOX5
SCHEMBL2019189 1.00 THRA (0.52) THRATHRBPPARALIPGALOX5
SCHEMBL29813570 1.00 THRA (0.52) THRATHRBPPARALIPGALOX5
SCHEMBL1021215 0.94 THRA (0.44) THRATHRBPPARALIPGALOX5
SCHEMBL11674754 0.92 THRA (0.59) THRATHRBPPARALIPGALOX5
SCHEMBL8393505 0.92 THRA (0.59) THRATHRBPPARALIPGALOX5
SCHEMBL6849772 0.92 THRA (0.59) THRATHRBPPARALIPGALOX5
SCHEMBL1100557 0.92 THRA (0.59) THRATHRBPPARALIPGALOX5
SCHEMBL4004612 0.92 THRA (0.59) THRATHRBPPARALIPGALOX5

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
EP-2432815-B1 POLYUREA WHICH CAN BE PRODUCED FROM TWO POLYETHERAMINES AND A PREPOLYMER BASF SE (DE) 2013-10-23 EP disclosed
EP-0451656-A2 Process for preparing films for linings of plastic moulds, and the use of such lined moulds BAYER AG (DE) 1991-10-16 EP disclosed
EP-0348760-A2 Process for the production of moulded articles and moulded articles produced according to this process BAYER AG (DE) 1990-01-03 EP disclosed