SCHEMBL1035772

SCHEMBL1035772

CCCOC(=O)CP(=O)(C(=O)c1c(C)cc(C)cc1C)C(=O)c1c(C)cc(C)cc1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
LMNA P02545 3/20 0.36
MEN1 O00255 1/20 0.36
HPGD P15428 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP3A4 P08684 2/20 0.36
ITGB1 P05556 1/20 0.36
ITGA4 P13612 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
NLRP3 Q96P20 1/20 0.35
KDM4E B2RXH2 2/20 0.35
MAPT P10636 1/20 0.35
TSHR P16473 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
NR1H2 P55055 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
SCHEMBL1038249 0.90 ITGB1 (0.43) ALDH1A1LMNAMEN1KMT2ACYP3A4
SCHEMBL1039014 0.89 NLRP3 (0.44) ALDH1A1SMN1; SMN2LMNAMEN1HPGD
SCHEMBL2882497 0.89 NAAA (0.44) ALDH1A1LMNAITGB1ITGA4TSHR
SCHEMBL1036203 0.89 NAAA (0.44) ALDH1A1LMNAITGB1ITGA4TSHR
SCHEMBL1035836 0.89 NAAA (0.44) ALDH1A1LMNAITGB1ITGA4TSHR
SCHEMBL1035930 0.89 NAAA (0.44) ALDH1A1LMNAITGB1ITGA4TSHR
SCHEMBL1036933 0.89 NAAA (0.44) ALDH1A1LMNAITGB1ITGA4TSHR
SCHEMBL17827610 0.86 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2LMNAMEN1HPGD
SCHEMBL1038238 0.85 ITGB1 (0.40) MEN1KMT2AITGB1ITGA4MAPT
SCHEMBL2886656 0.85 CRHR1 (0.34) SMN1; SMN2LMNAMEN1HPGDKMT2A

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
EP-1814891-B1 BISACYLPHOSPHANES AND THEIR USE AS PHOTOINITIATORS; PROCESS FOR PREPARING ACYLPHOSPHANES BASF SE (DE) 2011-01-26 EP disclosed