SCHEMBL9760306

SCHEMBL9760306

CCCCCCCOC(C)c1ccc(-c2ccc(C(=O)Oc3ccccc3CCC)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.44
THRB P10828 1/20 0.44
NPSR1 Q6W5P4 1/20 0.42
RARB P10826 7/20 0.39
LTB4R Q15722 1/20 0.39
LTB4R2 Q9NPC1 1/20 0.39
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
RARA P10276 1/20 0.38
MTOR P42345 1/20 0.38
KMT2A Q03164 1/20 0.38
UGCG Q16739 4/20 0.38
GBA2 Q9HCG7 4/20 0.38
GBA1 P04062 3/20 0.38
LCT P09848 3/20 0.38
MGAM O43451 2/20 0.38
SI P14410 2/20 0.38
PTPN11 Q06124 1/20 0.38
NPC1 O15118 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
SCHEMBL9761883 1.00 THRA (0.44) THRATHRBNPSR1RARBLTB4R
SCHEMBL9760452 1.00 THRA (0.44) THRATHRBNPSR1RARBLTB4R
SCHEMBL9760428 1.00 THRA (0.44) THRATHRBNPSR1RARBLTB4R
SCHEMBL9762502 1.00 THRA (0.44) THRATHRBNPSR1RARBLTB4R
SCHEMBL9762040 1.00 THRA (0.44) THRATHRBNPSR1RARBLTB4R
SCHEMBL9762096 1.00 THRA (0.44) THRATHRBNPSR1RARBLTB4R
SCHEMBL9761075 1.00 THRA (0.44) THRATHRBNPSR1RARBLTB4R
SCHEMBL9762347 1.00 THRA (0.44) THRATHRBNPSR1RARBLTB4R
SCHEMBL9762172 1.00 THRA (0.44) THRATHRBNPSR1RARBLTB4R
SCHEMBL9760566 0.99 NPSR1 (0.42) THRATHRBNPSR1RARBLTB4R

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