SCHEMBL6675869

SCHEMBL6675869

O=[PH](OCN(CCOCCO)CCOCCO)OCN(CCOCCO)CCOCCO

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.40
MAPK1 P28482 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
BLM P54132 1/20 0.36
PMP22 Q01453 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL6675873 0.86 TSHR (0.39) TSHRMAPK1MEN1KMT2ABLM
SCHEMBL2469007 0.81 KDM4E (0.32)
SCHEMBL7795689 0.75
SCHEMBL1463983 0.75 TSHR (0.62) TSHRMAPK1MEN1KMT2ABLM
SCHEMBL28496778 0.73 MEN1 (0.58) TSHRMAPK1MEN1KMT2AALDH1A1
SCHEMBL16007816 0.73 MEN1 (0.58) TSHRMAPK1MEN1KMT2AALDH1A1
SCHEMBL28500245 0.73 MEN1 (0.58) TSHRMAPK1MEN1KMT2AALDH1A1
SCHEMBL11853490 0.73
SCHEMBL12907797 0.73 MEN1 (0.65) TSHRMAPK1MEN1KMT2ABLM
SCHEMBL30359262 0.73 TSHR (0.59) TSHRMAPK1MEN1KMT2ABLM

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-1468033-A1 PHOSPHORUS-CONTAINING URETHANE (METH)ACRYLATE COMPOUNDS AND PHOTOSENSITIVE COMPOSITIONS Showa Denko K.K. (JP) 2004-10-20 EP disclosed
WO-2003062296-A1 PHOSPHORUS-CONTAINING URETHANE (METH)ACRYLATE COMPOUNDS AND PHOTOSENSITIVE COMPOSITIONS SHOWA DENKO K. K. (JP) 2003-07-31 WO disclosed