SCHEMBL8624176

SCHEMBL8624176

CCOP(=O)(OCC)C(CCCN(C)Cc1ccccc1)P(=O)(OCC)OCC

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.47
ATM Q13315 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
LMNA P02545 2/20 0.43
MAOB P27338 2/20 0.43
CARM1 Q86X55 1/20 0.43
PRMT6 Q96LA8 1/20 0.43
PRMT8 Q9NR22 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
KDM4A O75164 2/20 0.42
KDM4C Q9H3R0 2/20 0.42
POLB P06746 1/20 0.42
TMEM97 Q5BJF2 3/20 0.42
OPRM1 P35372 1/20 0.42
OPRK1 P41145 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
APP P05067 1/20 0.41

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
SCHEMBL8615964 0.84 GAA (0.43) SIGMAR1ATMMEN1KMT2ALMNA
SCHEMBL9222544 0.81 GAA (0.41) SIGMAR1MEN1KMT2ALMNAALDH1A1
SCHEMBL9227103 0.81 PYCR1 (0.42) SIGMAR1MEN1KMT2ALMNAMAOB
SCHEMBL11138286 0.80 FDFT1 (0.49) MEN1KMT2ALMNAALDH1A1MAPT
SCHEMBL9229838 0.78 MAPT (0.43) SIGMAR1LMNAALDH1A1MAPTPOLB
SCHEMBL9224135 0.76 ACHE (0.46) SIGMAR1MEN1KMT2ATMEM97APP
SCHEMBL6924991 0.76 SIGMAR1 (0.53) SIGMAR1ATMMEN1KMT2ALMNA
SCHEMBL15981064 0.74 GAA (0.36) LMNAALDH1A1MAPTPOLB
SCHEMBL5007472 0.74 ALDH1A1 (0.49) MEN1KMT2ALMNAALDH1A1MAPT
SCHEMBL8399769 0.73 SIGMAR1 (0.57) SIGMAR1ATMLMNAMAOBCARM1

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
US-5719303-A USEFUL FOR MEDICALLY TREATING HYPERLIPEMIA EISAI CO., LTD. (JP) 1998-02-17 US disclosed
EP-0688325-A1 PHOSPHONIC ACID DERIVATIVES Eisai Co., Ltd. (JP) 1995-12-27 EP disclosed
WO-1994020508-A1 PHOSPHONIC ACID DERIVATIVES EISAI CO., LTD. (JP) 1994-09-15 WO disclosed