SCHEMBL9874808

SCHEMBL9874808

CO[P](=O)c1ccccc1C(=O)c1c(C)cc(C)cc1C

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
HPGD P15428 4/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MCOLN3 Q8TDD5 1/20 0.39
ABCB1 P08183 1/20 0.38
METAP2 P50579 1/20 0.37
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 3/20 0.35
HSD11B1 P28845 1/20 0.34
FFAR4 Q5NUL3 1/20 0.33
MAPT P10636 2/20 0.33
TP53 P04637 1/20 0.33
CRHR1 P34998 1/20 0.33
HSD17B10 Q99714 2/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL1253600 0.85 KMT2A (0.40) KMT2AMEN1HPGDNPSR1MCOLN3
SCHEMBL29435246 0.84 KMT2A (0.43) KMT2AMEN1HPGDNPSR1MCOLN3
SCHEMBL3685865 0.84 KMT2A (0.43) KMT2AMEN1HPGDNPSR1MCOLN3
SCHEMBL1138268 0.79 KMT2A (0.43) KMT2AMEN1HPGDNPSR1MCOLN3
SCHEMBL7178175 0.79 KMT2A (0.40) KMT2AMEN1HPGDNPSR1MCOLN3
SCHEMBL7182214 0.79 HPGD (0.42) KMT2AMEN1HPGDNPSR1MCOLN3
SCHEMBL7179788 0.79 HPGD (0.43) KMT2AMEN1HPGDNPSR1MCOLN3
SCHEMBL28258477 0.79 KMT2A (0.47) KMT2AMEN1HPGDNPSR1MCOLN3
SCHEMBL7188505 0.78 ABCB1 (0.43) KMT2AMEN1ABCB1ALDH1A1MAPT
SCHEMBL7183573 0.77 KMT2A (0.39) KMT2AMEN1HPGDNPSR1MCOLN3

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
US-4985472-A ACRYLATED POLYISOCYANATE MITSUBISHI RAYON COMPANY, LTD. (JP) 1991-01-15 US disclosed
EP-0313665-A1 ACTINIC RADIATION-CURABLE COMPOSITION FOR CAST POLYMERIZATION AND PRODUCT OF CAST POLYMERIZATION MITSUBISHI RAYON CO., LTD. (JP) 1989-05-03 EP disclosed