SCHEMBL2854023

SCHEMBL2854023

CN(OP(=O)(O)O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.56
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
SRC P12931 2/20 0.43
CA2 P00918 2/20 0.38
CA4 P22748 1/20 0.38
CA5A P35218 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
HPGD P15428 2/20 0.36
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
USP2 O75604 1/20 0.36
PDE3A Q14432 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TSHR P16473 2/20 0.35
FAAH O00519 1/20 0.35
PHGDH O43175 1/20 0.35
MGLL Q99685 1/20 0.35
GLA P06280 1/20 0.35
CA12 O43570 1/20 0.35

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
SCHEMBL2854021 0.83 HTT (0.60) HTTMEN1KMT2ACA2NPSR1
SCHEMBL21176803 0.78 MEN1 (0.48) HTTMEN1KMT2ASRCCA2
SCHEMBL28672425 0.75 MEN1 (0.45) HTTMEN1KMT2ASRCCA2
Pyrophosphoric Acid SCHEMBL28134259 0.75 MEN1 (0.50) HTTMEN1KMT2ASRCHPGD
SCHEMBL28441187 0.75 HTT (0.50) HTTMEN1KMT2ASRCHPGD
SCHEMBL2855667 0.75 MEN1 (0.45) HTTMEN1KMT2ASRCHPGD
SCHEMBL6848277 0.73 MEN1 (0.37) HTTMEN1KMT2ASRCALDH1A1
SCHEMBL1297782 0.73 MEN1 (0.44) HTTMEN1KMT2ASRCCA2
SCHEMBL4376511 0.73 MEN1 (0.35) HTTMEN1KMT2ASRCALDH1A1
Phosphoric Acid SCHEMBL1764333 0.73 MEN1 (0.58) HTTMEN1KMT2ASRCCA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1449955-B1 METHOD OF FLAMEPROOFING FOR POLYESTER BASED TEXTILE PRODUCT DAIKYO CHEMICAL CO LTD (JP) 2010-01-13 EP disclosed
US-7588802-B2 Agent and method for flame-retardant processing of polyester-based fiber products DAIKYO CHEMICAL CO., LTD. (JP) 2009-09-15 US disclosed
US-20080292797-A1 Agent and method for flame-retardant processing of polyester-based fiber products IWAKI TERUFUMI 2008-11-27 US disclosed
US-7425352-B2 Flameproofing agent for polyester-based textile product and method of flameproofing DAIKYO CHEMICAL CO., LTD. (JP) 2008-09-16 US disclosed
EP-1449955-A1 FLAMEPROOFING AGENT FOR POLYESTER BASED TEXTILE PRODUCT AND METHOD OF FLAMEPROOFING Daikyo Chemical Co., Ltd (JP) 2004-08-25 EP disclosed