SCHEMBL30996363

SCHEMBL30996363

C=CC(=O)OC(CCCCCC)CCCCCOc1ccccc1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
NR1I2 O75469 1/20 0.53
LMNA P02545 1/20 0.53
CHRM2 P08172 1/20 0.53
CYP3A4 P08684 1/20 0.53
ADRA2A P08913 1/20 0.53
MAPT P10636 1/20 0.53
OPRK1 P41145 1/20 0.53
HTR2B P41595 1/20 0.53
SLC6A3 Q01959 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
PTPN11 Q06124 4/20 0.51
ALDH1A1 P00352 3/20 0.49
KDM4E B2RXH2 1/20 0.47
RECQL P46063 1/20 0.47
NPSR1 Q6W5P4 1/20 0.46
THRA P10827 1/20 0.46
THRB P10828 1/20 0.46
PTPN1 P18031 2/20 0.46

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
SCHEMBL10784523 0.98 KMT2A (0.50) KMT2AMEN1NR1I2LMNACHRM2
Hydroquinone SCHEMBL28396271 0.94 KMT2A (0.46) KMT2AMEN1NR1I2LMNACHRM2
SCHEMBL29497651 0.93 KMT2A (0.49) KMT2AMEN1NR1I2LMNACHRM2
Hydroquinone SCHEMBL28395786 0.89 KMT2A (0.45) KMT2AMEN1NR1I2LMNACHRM2
SCHEMBL1359914 0.87 KMT2A (0.49) KMT2AMEN1NR1I2LMNACHRM2
SCHEMBL29497615 0.85 THRA (0.47) KMT2AMEN1NR1I2LMNACHRM2
SCHEMBL29497657 0.84 KMT2A (0.40) KMT2AMEN1NR1I2LMNACHRM2
SCHEMBL10788091 0.83 KMT2A (0.49) KMT2AMEN1NR1I2LMNACHRM2
SCHEMBL112985 0.83 KMT2A (0.74) KMT2AMEN1NR1I2LMNACHRM2
SCHEMBL3665313 0.83 KMT2A (0.74) KMT2AMEN1NR1I2LMNACHRM2

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
CN-115916853-B Polymer, and photo-alignment film and retardation film using the same 大阪有机化学工业株式会社 2024-07-09 CN disclosed