SCHEMBL937979

SCHEMBL937979

CCCCc1ccc(OC(=O)CCCCC(=O)Oc2ccc(CCCC)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.58
THRA P10827 1/20 0.55
KMT2A Q03164 4/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
ALDH1A1 P00352 2/20 0.51
HSD17B10 Q99714 2/20 0.51
HPGD P15428 1/20 0.51
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.50
HTT P42858 1/20 0.50
ALOX15 P16050 1/20 0.49
BCL9 O00512 1/20 0.47
CTNNB1 P35222 1/20 0.47
FAAH O00519 1/20 0.47
RARB P10826 1/20 0.47
PLK1 P53350 1/20 0.47

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
SCHEMBL28018021 0.97 THRB (0.60) THRBTHRAKMT2ASMN1; SMN2ALDH1A1
SCHEMBL8093625 0.97 THRB (0.60) THRBTHRAKMT2ASMN1; SMN2ALDH1A1
SCHEMBL27557676 0.94 ALDH1A1 (0.54) THRBTHRAKMT2ASMN1; SMN2ALDH1A1
SCHEMBL2885452 0.93 THRB (0.64) THRBTHRAKMT2ASMN1; SMN2ALDH1A1
SCHEMBL27503295 0.93 THRB (0.64) THRBTHRAKMT2ASMN1; SMN2ALDH1A1
SCHEMBL24372243 0.93 THRB (0.64) THRBTHRAKMT2ASMN1; SMN2ALDH1A1
SCHEMBL10620500 0.93 THRB (0.64) THRBTHRAKMT2ASMN1; SMN2ALDH1A1
SCHEMBL28748404 0.93 THRB (0.64) THRBTHRAKMT2ASMN1; SMN2ALDH1A1
SCHEMBL7930191 0.93 THRB (0.64) THRBTHRAKMT2ASMN1; SMN2ALDH1A1
SCHEMBL27503643 0.93 THRB (0.64) THRBTHRAKMT2ASMN1; SMN2ALDH1A1

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
WO-2010088194-A9 LITHOGRAPHIC TOOL IN SITU CLEAN FORMULATIONS ADVANCED TECHNOLOGY MATERIALS, INC. (US) 2011-01-27 WO disclosed
WO-2010088194-A2 LITHOGRAPHIC TOOL IN SITU CLEAN FORMULATIONS ADVANCED TECHNOLOGY MATERIALS, INC. (US) 2010-08-05 WO disclosed