SCHEMBL9760823

SCHEMBL9760823

CCCCCCc1ccc(C(=O)Oc2ccc(-c3ccc(C(C)OC)cc3)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
RARB P10826 7/20 0.52
MEN1 O00255 1/20 0.52
ALDH1A1 P00352 1/20 0.52
RARA P10276 1/20 0.52
MTOR P42345 1/20 0.52
KMT2A Q03164 1/20 0.52
THRB P10828 4/20 0.48
THRA P10827 2/20 0.48
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
NPC1 O15118 1/20 0.44
LMNA P02545 1/20 0.44
MGLL Q99685 1/20 0.44

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
SCHEMBL9760665 1.00 MAPT (0.56) MAPTSMN1; SMN2RARBMEN1ALDH1A1
SCHEMBL9760554 1.00 MAPT (0.56) MAPTSMN1; SMN2RARBMEN1ALDH1A1
SCHEMBL9762036 1.00 MAPT (0.56) MAPTSMN1; SMN2RARBMEN1ALDH1A1
SCHEMBL9762131 1.00 MAPT (0.56) MAPTSMN1; SMN2RARBMEN1ALDH1A1
SCHEMBL9760847 1.00 MAPT (0.56) MAPTSMN1; SMN2RARBMEN1ALDH1A1
SCHEMBL9761514 1.00 MAPT (0.56) MAPTSMN1; SMN2RARBMEN1ALDH1A1
SCHEMBL9760282 1.00 MAPT (0.56) MAPTSMN1; SMN2RARBMEN1ALDH1A1
SCHEMBL9761109 1.00 MAPT (0.56) MAPTSMN1; SMN2RARBMEN1ALDH1A1
SCHEMBL9760351 1.00 MAPT (0.56) MAPTSMN1; SMN2RARBMEN1ALDH1A1
SCHEMBL9761520 1.00 MAPT (0.56) MAPTSMN1; SMN2RARBMEN1ALDH1A1

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