SCHEMBL7217971

SCHEMBL7217971

CCCCCCCCCCCCCCCCOC[C@@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC

nearest known ligand 0.92

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.92
SMN1; SMN2 Q16637 2/20 0.84
NR5A2 O00482 1/20 0.84
NR5A1 Q13285 1/20 0.84
ALDH1A1 P00352 2/20 0.80
ADRA1D P25100 1/20 0.80
PTAFR P25105 1/20 0.80
HTR1D P28221 1/20 0.80
HTR2C P28335 1/20 0.80
ADRA1B P35368 1/20 0.80
DRD3 P35462 1/20 0.80
TMEM97 Q5BJF2 1/20 0.80
MAPT P10636 1/20 0.74
PRKD3 O94806 1/20 0.73
PRKCG P05129 1/20 0.73
PRKCB P05771 1/20 0.73
PRKCA P17252 1/20 0.73
PRKCH P24723 1/20 0.73
AKT1 P31749 1/20 0.73
PRKCI P41743 1/20 0.73

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
SCHEMBL30655275 1.00 RECQL (0.92) RECQLSMN1; SMN2NR5A2NR5A1ALDH1A1
SCHEMBL30650607 1.00 RECQL (0.92) RECQLSMN1; SMN2NR5A2NR5A1ALDH1A1
SCHEMBL30547650 1.00 RECQL (0.92) RECQLSMN1; SMN2NR5A2NR5A1ALDH1A1
SCHEMBL30690843 1.00 RECQL (0.92) RECQLSMN1; SMN2NR5A2NR5A1ALDH1A1
SCHEMBL1394777 1.00 RECQL (0.92) RECQLSMN1; SMN2NR5A2NR5A1ALDH1A1
SCHEMBL4661993 1.00 RECQL (0.92) RECQLSMN1; SMN2NR5A2NR5A1ALDH1A1
SCHEMBL31443474 1.00 RECQL (0.92) RECQLSMN1; SMN2NR5A2NR5A1ALDH1A1
SCHEMBL1428475 1.00 RECQL (0.92) RECQLSMN1; SMN2NR5A2NR5A1ALDH1A1
SCHEMBL30650550 1.00 RECQL (0.92) RECQLSMN1; SMN2NR5A2NR5A1ALDH1A1
SCHEMBL30547575 1.00 RECQL (0.92) RECQLSMN1; SMN2NR5A2NR5A1ALDH1A1

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
EP-1272160-A2 LIPID-BASED DRUG DELIVERY SYSTEMS FOR TOPICAL APPLICATION Liplasome Pharma A/S (DK) 2003-01-08 EP disclosed
WO-2001076555-A2 LIPID-BASED DRUG DELIVERY SYSTEMS FOR TOPICAL APPLICATION LIPLASOME PHARMA A/S (DK) 2001-10-18 WO disclosed