SCHEMBL14373507

SCHEMBL14373507

C=CC(=O)Oc1ccc(C#Cc2ccc(C(=O)Oc3ccc(OC(=O)c4ccc(CCCCC)cc4)cc3)cc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 12/20 0.72
THRA P10827 10/20 0.53
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.49
MAPT P10636 1/20 0.49
NPC1 O15118 2/20 0.45
LMNA P02545 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
PRSS1 P07477 1/20 0.43
ACR P10323 1/20 0.43
PLA2G1B P04054 1/20 0.42
ATG4B Q9Y4P1 1/20 0.42

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
SCHEMBL3609976 0.93 THRB (0.84) THRBTHRAMEN1KMT2ASMN1; SMN2
SCHEMBL74264 0.93 THRB (0.84) THRBTHRAMEN1KMT2ASMN1; SMN2
SCHEMBL14373515 0.92 THRB (0.70) THRBTHRAKMT2ASMN1; SMN2MAPT
SCHEMBL13906786 0.92 THRB (0.82) THRBTHRAMEN1KMT2ASMN1; SMN2
SCHEMBL14373513 0.92 THRB (0.82) THRBTHRAMEN1KMT2ASMN1; SMN2
SCHEMBL14907445 0.91 THRB (0.59) THRBTHRAMEN1KMT2ASMN1; SMN2
SCHEMBL21339808 0.90 THRB (0.58) THRBTHRAMEN1KMT2ASMN1; SMN2
SCHEMBL14907441 0.90 THRB (0.58) THRBTHRAMEN1KMT2ASMN1; SMN2
SCHEMBL14373517 0.89 THRB (0.78) THRBTHRAMEN1KMT2AMAPT
SCHEMBL3618792 0.89 THRB (0.76) THRBTHRAMEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070238026-A1 Holographic recording composition, optical recording medium and optical recording method FUJIFILM CORPORATION (JP) 2007-10-11 US disclosed