SCHEMBL9762346

SCHEMBL9762346

CCCc1ccccc1OC(=O)c1ccc(C(C)OCC)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.47
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 1/20 0.38
HTR1A P08908 1/20 0.37
ADRA2A P08913 1/20 0.37
ADRA2B P18089 1/20 0.37
ADRA2C P18825 1/20 0.37
PPARG P37231 2/20 0.36
PPARA Q07869 2/20 0.36
PPARD Q03181 1/20 0.36
MAPT P10636 1/20 0.36
SLC6A3 Q01959 1/20 0.36
ADRB2 P07550 1/20 0.36
POLB P06746 1/20 0.35
SERPINE1 P05121 1/20 0.35
PRSS1 P07477 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
SCHEMBL9760482 0.96 NPSR1 (0.45) NPSR1THRATHRBKMT2ASMN1; SMN2
SCHEMBL9762273 0.93 NPSR1 (0.46) NPSR1THRATHRBKMT2ASMN1; SMN2
SCHEMBL9760888 0.91 NPSR1 (0.46) NPSR1THRATHRBKMT2ASMN1; SMN2
SCHEMBL9762305 0.91 THRA (0.52) NPSR1THRATHRBPPARGPPARA
SCHEMBL9760612 0.91 THRA (0.52) NPSR1THRATHRBPPARGPPARA
SCHEMBL9760588 0.90 NPSR1 (0.46) NPSR1THRATHRBKMT2ASMN1; SMN2
SCHEMBL9761934 0.90 NPSR1 (0.43) NPSR1THRATHRBPPARGPPARA
SCHEMBL9761656 0.89 NPSR1 (0.48) NPSR1THRATHRBKMT2ASMN1; SMN2
SCHEMBL9761827 0.88 THRA (0.46) NPSR1THRATHRBKMT2ASMN1; SMN2
SCHEMBL9761571 0.88 THRA (0.46) NPSR1THRATHRBKMT2ASMN1; SMN2

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-0297745-B1 OPTICALLY ACTIVE ETHER DERIVATIVES, PREPARATION PROCESSES THEREFOR, LIQUID CRYSTAL MATERIALS AND AN OPTICAL SWITCHING ELEMENT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-09-18 EP disclosed
US-5013479-A Aromatic ether esters containing two or three benzene rings SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-05-07 US disclosed
EP-0297745-A1 Optically active ether derivatives, preparation processes therefor, liquid crystal materials and an optical switching element SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-01-04 EP disclosed