SCHEMBL8106422

SCHEMBL8106422

CCOP(=O)(OCC)C(=O)c1c(OC)cc(OC)c(C(=O)P(=O)(OCC)OCC)c1OC

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.47
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPK1 P28482 1/20 0.37
LMNA P02545 2/20 0.36
CYP3A4 P08684 2/20 0.36
MAPT P10636 1/20 0.35
PTGS2 P35354 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
NR1I2 O75469 1/20 0.34

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
SCHEMBL9245958 0.85 LMNA (0.39) L3MBTL1KMT2AALDH1A1LMNANR1I2
SCHEMBL8106420 0.84 L3MBTL1 (0.38) L3MBTL1KMT2AMEN1ALDH1A1KDM4E
SCHEMBL67966 0.79 CA12 (0.50) ALDH1A1KDM4EMAPTCA12CA1
SCHEMBL9245967 0.75 BRD4 (0.38) L3MBTL1KMT2AALDH1A1KDM4ELMNA
SCHEMBL8103110 0.74 HTR1A (0.42) L3MBTL1KMT2AMEN1ALDH1A1KDM4E
SCHEMBL9752929 0.72 HMGCR (0.50) KMT2AMEN1ALDH1A1KDM4ECYP3A4
SCHEMBL68708 0.71 SMN1; SMN2 (0.41) L3MBTL1KMT2AMEN1ALDH1A1LMNA
SCHEMBL9245953 0.71 KCNK3 (0.43) L3MBTL1KDM4EMAPK1LMNAMAPT
SCHEMBL9248907 0.70 KMT2A (0.39) L3MBTL1KMT2AMEN1ALDH1A1MAPK1
SCHEMBL13811176 0.70 TAAR1 (0.48) ALDH1A1KDM4EMAPTCA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0601413-B1 Method for the productin of Arene bisphosphinoxides BASF AG (DE) 2000-01-26 EP disclosed
US-5410060-A Haloacetylation, carboxylation, phosphination BASF AKTIENGESELLSCHAFT (DE) 1995-04-25 US disclosed
EP-0601413-A1 Arene bisphosphinoxides BASF Aktiengesellschaft (DE) 1994-06-15 EP disclosed