SCHEMBL7210214

SCHEMBL7210214

CCCCc1ccc(OC(=O)c2ccc(C(=O)Oc3ccc(CCCC)cc3)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 6/20 0.58
MAPT P10636 4/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
RARB P10826 1/20 0.56
PLK1 P53350 1/20 0.56
THRA P10827 2/20 0.55
NPC1 O15118 2/20 0.54
LMNA P02545 2/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
PRSS1 P07477 1/20 0.54
ACR P10323 1/20 0.54
NFKB1 P19838 1/20 0.52
NFKB2 Q00653 1/20 0.52
RELA Q04206 1/20 0.52
KMT2A Q03164 1/20 0.52
CYP4A11 Q02928 2/20 0.51

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
SCHEMBL5665942 1.00 THRB (0.58) THRBMAPTSMN1; SMN2RARBPLK1
SCHEMBL7951967 1.00 THRB (0.58) THRBMAPTSMN1; SMN2RARBPLK1
SCHEMBL778221 1.00 THRB (0.58) THRBMAPTSMN1; SMN2RARBPLK1
SCHEMBL5665862 0.97 THRB (0.63) THRBMAPTSMN1; SMN2RARBPLK1
SCHEMBL11699664 0.97 MAPT (0.55) THRBMAPTSMN1; SMN2RARBPLK1
SCHEMBL5666123 0.97 THRB (0.63) THRBMAPTSMN1; SMN2RARBPLK1
SCHEMBL11695074 0.97 MAPT (0.55) THRBMAPTSMN1; SMN2RARBPLK1
SCHEMBL9511143 0.95 THRB (0.62) THRBMAPTSMN1; SMN2RARBTHRA
SCHEMBL11547222 0.95 RARB (0.64) THRBMAPTSMN1; SMN2RARBPLK1
SCHEMBL11584932 0.95 MAPT (0.54) THRBMAPTSMN1; SMN2RARBPLK1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114956976-A Novel indenofluorene-6, 12-diketone derivative and synthetic method and application thereof 商丘师范学院 2022-08-30 CN disclosed
CN-103613694-A Preparation method of polyethylene terephthalic acid di[4-butyl phenol] ester UNIV NANCHANG HANGKONG 2014-03-05 CN disclosed
EP-1114841-B1 PROCESS FOR PRODUCING POLYARYLATE TEIJIN LTD (JP) 2003-10-08 EP disclosed
US-6417291-B1 CONDENSATION POLYMERIZATION AND ESTERIFICATION OF AROMATIC DIOL AND ESTER-FORMING MONOMER; ENDCAPPING WITH SALICYLIC ACID ESTER DERIVATIVE TEIJIN LIMITED (JP) 2002-07-09 US disclosed
EP-1114841-A1 PROCESS FOR PRODUCING POLYARYLATE TEIJIN LIMITED (JP) 2001-07-11 EP disclosed