SCHEMBL9760965

SCHEMBL9760965

CCCCCCCCCCCCOC(C)c1ccc(-c2ccc(C(=O)Oc3ccccc3CCCCCCCCCCCC)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.49
THRB P10828 1/20 0.49
NPSR1 Q6W5P4 1/20 0.42
RARB P10826 8/20 0.41
PPARA Q07869 2/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
RARA P10276 1/20 0.41
MAPT P10636 1/20 0.41
MTOR P42345 1/20 0.41
KMT2A Q03164 1/20 0.41
PPARG P37231 1/20 0.41
LTB4R Q15722 1/20 0.39
LTB4R2 Q9NPC1 1/20 0.39
UGCG Q16739 3/20 0.38
GBA2 Q9HCG7 3/20 0.38
GBA1 P04062 2/20 0.38
LCT P09848 2/20 0.38
PTPN11 Q06124 1/20 0.38
MGAM O43451 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
SCHEMBL9762180 1.00 THRA (0.49) THRATHRBNPSR1RARBPPARA
SCHEMBL9762380 1.00 THRA (0.49) THRATHRBNPSR1RARBPPARA
SCHEMBL9761110 1.00 THRA (0.49) THRATHRBNPSR1RARBPPARA
SCHEMBL9761474 1.00 THRA (0.49) THRATHRBNPSR1RARBPPARA
SCHEMBL9762028 1.00 THRA (0.49) THRATHRBNPSR1RARBPPARA
SCHEMBL9762276 1.00 THRA (0.49) THRATHRBNPSR1RARBPPARA
SCHEMBL9760935 1.00 THRA (0.49) THRATHRBNPSR1RARBPPARA
SCHEMBL9762217 1.00 THRA (0.49) THRATHRBNPSR1RARBPPARA
SCHEMBL9761182 1.00 THRA (0.49) THRATHRBNPSR1RARBPPARA
SCHEMBL9761764 1.00 THRA (0.49) THRATHRBNPSR1RARBPPARA

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 2 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