SCHEMBL9513715

SCHEMBL9513715

CCCCCCCCCC=COc1ccccc1C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
RECQL P46063 1/20 0.52
SOAT2 O75908 1/20 0.46
SOAT1 P35610 1/20 0.46
LMNA P02545 2/20 0.46
MAPT P10636 2/20 0.46
NR1I2 O75469 1/20 0.46
CHRM2 P08172 1/20 0.46
CYP3A4 P08684 1/20 0.46
ADRA2A P08913 1/20 0.46
OPRK1 P41145 1/20 0.46
HTR2B P41595 1/20 0.46
SLC6A3 Q01959 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
ALDH1A1 P00352 3/20 0.45
PTPN11 Q06124 2/20 0.44
HTT P42858 1/20 0.44
FAAH O00519 3/20 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
SCHEMBL9513712 1.00 KDM4E (0.52) KDM4EMEN1KMT2ARECQLSOAT2
SCHEMBL31279976 1.00 KDM4E (0.52) KDM4EMEN1KMT2ARECQLSOAT2
SCHEMBL10892005 1.00 KDM4E (0.52) KDM4EMEN1KMT2ARECQLSOAT2
SCHEMBL6716587 1.00 KDM4E (0.52) KDM4EMEN1KMT2ARECQLSOAT2
SCHEMBL1225718 0.94 KDM4E (0.55) KDM4EMEN1KMT2ARECQLLMNA
SCHEMBL29518581 0.94 KDM4E (0.55) KDM4EMEN1KMT2ARECQLLMNA
SCHEMBL9565558 0.94 KDM4E (0.55) KDM4EMEN1KMT2ARECQLLMNA
SCHEMBL4667495 0.92 MEN1 (0.50) KDM4EMEN1KMT2ARECQLSOAT2
SCHEMBL4798077 0.89 KDM4E (0.47) KDM4EMEN1KMT2ARECQLSOAT2
Salicylic Acid SCHEMBL29596262 0.88 KDM4E (0.49) KDM4EMEN1KMT2ARECQLLMNA

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
EP-0344779-B1 Liquid-crystalline organopolysiloxanes TORAY SILICONE CO (JP) 1993-10-20 EP disclosed
EP-0344779-A2 Liquid-crystalline organopolysiloxanes TORAY SILICONE COMPANY, LIMITED (JP) 1989-12-06 EP disclosed