SCHEMBL28049124

SCHEMBL28049124

CCCCCOc1ccc([P](=O)C(=O)c2c(C)cccc2C)c(OCCCCC)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G4B P0C869 3/20 0.44
SMPD1 P17405 3/20 0.43
THRA P10827 2/20 0.41
THRB P10828 2/20 0.41
PTPN11 Q06124 2/20 0.41
MEN1 O00255 1/20 0.40
NR1I2 O75469 1/20 0.40
LMNA P02545 1/20 0.40
CHRM2 P08172 1/20 0.40
CYP3A4 P08684 1/20 0.40
ADRA2A P08913 1/20 0.40
MAPT P10636 1/20 0.40
OPRK1 P41145 1/20 0.40
HTR2B P41595 1/20 0.40
SLC6A3 Q01959 1/20 0.40
KMT2A Q03164 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
TSHR P16473 2/20 0.40
TP53 P04637 1/20 0.40
ALOX5 P09917 1/20 0.40

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
SCHEMBL14334515 0.91 ITGB1 (0.47) PLA2G4BTHRATHRBPTPN11TSHR
SCHEMBL1853827 0.81 ITGB1 (0.47) PLA2G4BTHRATHRBPTPN11TSHR
SCHEMBL29424084 0.81 ITGB1 (0.47) PLA2G4BTHRATHRBPTPN11TSHR
SCHEMBL12520686 0.81 RARB (0.43) PLA2G4BPTPN11TSHRTP53
SCHEMBL4625104 0.80 ITGB1 (0.46) PLA2G4BTHRATHRBPTPN11TSHR
SCHEMBL4625095 0.80 ITGB1 (0.46) PLA2G4BTHRATHRBPTPN11TSHR
SCHEMBL12520349 0.78 ITGB1 (0.43) THRATHRBMEN1MAPTKMT2A
SCHEMBL4623708 0.77 THRA (0.48) PLA2G4BSMPD1THRATHRBPTPN11
SCHEMBL7627834 0.76 GGPS1 (0.46) PLA2G4BSMPD1THRATHRBPTPN11
SCHEMBL29715644 0.76 GGPS1 (0.46) PLA2G4BSMPD1THRATHRBPTPN11

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-105164216-A Ink jet ink composition, ink jet recording method, ink set, decorative sheet, decorative sheet molded product, method for producing in-mold molded article, and in-mold molded article FUJIFILM CORP 2015-12-16 CN disclosed