SCHEMBL671456

SCHEMBL671456

CCCCCCCC/C=C\CCCCCCCC(=O)O[C@@H](CO)C(OP(=O)([O-])OCC[N+](C)(C)C)C(=O)CCCCCCCCCCCCC

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.53
NR5A2 O00482 1/20 0.53
NR5A1 Q13285 1/20 0.53
RECQL P46063 1/20 0.52
MAPT P10636 1/20 0.49
S1PR1 P21453 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
LMNA P02545 1/20 0.47
ESR1 P03372 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
CDC25A P30304 1/20 0.47
AGTR1 P30556 1/20 0.47
AKT1 P31749 1/20 0.47
ADRA1A P35348 1/20 0.47
KCNH2 Q12809 1/20 0.47
DAGLA Q9Y4D2 1/20 0.46
ADRA1D P25100 1/20 0.46
PTAFR P25105 1/20 0.46

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
SCHEMBL479222 1.00 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2NR5A2NR5A1RECQL
SCHEMBL479388 1.00 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2NR5A2NR5A1RECQL
SCHEMBL479198 1.00 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2NR5A2NR5A1RECQL
SCHEMBL37559 1.00 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2NR5A2NR5A1RECQL
SCHEMBL672371 1.00 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2NR5A2NR5A1RECQL
SCHEMBL4619726 0.97 ALDH1A1 (0.64) ALDH1A1SMN1; SMN2NR5A2NR5A1RECQL
SCHEMBL4619498 0.97 ALDH1A1 (0.64) ALDH1A1SMN1; SMN2NR5A2NR5A1RECQL
SCHEMBL479563 0.97 ALDH1A1 (0.64) ALDH1A1SMN1; SMN2NR5A2NR5A1RECQL
SCHEMBL479610 0.97 ALDH1A1 (0.64) ALDH1A1SMN1; SMN2NR5A2NR5A1RECQL
SCHEMBL1576782 0.96 ALDH1A1 (0.66) ALDH1A1SMN1; SMN2NR5A2NR5A1RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2629779-A2 USE OF STORAGE STABLE VISCOUS PHOSPHOLIPID DEPOT TO TREAT WOUNDS Dr. Reddy's Laboratories Inc. (US) 2013-08-28 EP disclosed
EP-2605751-A1 PHOSPHOLIPID DEPOT Dr. Reddy's Laboratories, Ltd. (IN) 2013-06-26 EP disclosed
WO-2012054447-A2 USE OF STORAGE STABLE VISCOUS PHOSPHOLIPID DEPOT TO TREAT WOUNDS DR. REDDY'S LABORATORIES, INC. (US) 2012-04-26 WO disclosed
WO-2012023955-A1 PHOSPHOLIPID DEPOT DR. REDDY'S LABORATORIES, LTD. (IN) 2012-02-23 WO disclosed
WO-2009129387-A2 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2009-10-22 WO disclosed
WO-2009129395-A1 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2009-10-22 WO disclosed