SCHEMBL1521671

SCHEMBL1521671

CC(C)CCCC(C)CCCC(C)CCCC(C)CC(=O)OC[C@H](COP(=O)([O-])[O-])OC(=O)CC(C)CCCC(C)CCCC(C)CCCC(C)C.[Na+].[Na+]

nearest known ligand 0.43

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.42
LPAR3 Q9UBY5 8/20 0.39
LPAR1 Q92633 5/20 0.39
ENPP2 Q13822 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NR5A2 O00482 1/20 0.37
NR5A1 Q13285 1/20 0.37
LPAR2 Q9HBW0 3/20 0.36
BLM P54132 1/20 0.35
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
LPAR6 P43657 1/20 0.34
LPAR4 Q99677 1/20 0.34
LPAR5 Q9H1C0 1/20 0.34
MAPT P10636 1/20 0.34
FABP3 P05413 1/20 0.33

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
SCHEMBL234142 0.89 ENPP2 (0.51) PRKCALPAR3LPAR1ENPP2SMN1; SMN2
SCHEMBL234633 0.84 SMN1; SMN2 (0.59) PRKCASMN1; SMN2NR5A2NR5A1BLM
SCHEMBL27219506 0.84 SMN1; SMN2 (0.59) PRKCASMN1; SMN2NR5A2NR5A1BLM
SCHEMBL21686371 0.83 PRKCA (0.50) PRKCABLMALDH1A1LMNA
SCHEMBL23761110 0.82 FABP3 (0.43) PRKCALPAR3LPAR1ENPP2SMN1; SMN2
SCHEMBL51010 0.82 FABP3 (0.43) PRKCALPAR3LPAR1ENPP2SMN1; SMN2
SCHEMBL29451071 0.82 FABP3 (0.43) PRKCALPAR3LPAR1ENPP2SMN1; SMN2
SCHEMBL26236288 0.82 SELP (0.49) PRKCALPAR3LPAR1ENPP2SMN1; SMN2
SCHEMBL20111594 0.82 FABP3 (0.43) PRKCALPAR3LPAR1ENPP2SMN1; SMN2
SCHEMBL480702 0.81 PRKCA (0.63) PRKCABLM

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
US-20110250237-A1 IMMUNOGENIC AMPHIPATHIC PEPTIDE COMPOSITIONS NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2011-10-13 US disclosed
EP-2313085-A2 IMMUNOGENIC AMPHIPATHIC PEPTIDE COMPOSITIONS Novartis AG (CH) 2011-04-27 EP disclosed
US-20110064755-A1 METHODS FOR PRODUCING BLOCK COPOLYMER/AMPHIPHILIC PARTICLES VICAL INCORPORATED (US) 2011-03-17 US disclosed
WO-2010009277-A9 IMMUNOGENIC AMPHIPATHIC PEPTIDE COMPOSITIONS NOVARTIS AG (CH) 2010-03-25 WO disclosed
WO-2010009277-A2 IMMUNOGENIC AMPHIPATHIC PEPTIDE COMPOSITIONS NOVARTIS AG (CH) 2010-01-21 WO disclosed
US-20060134221-A1 Methods for producing block copolymer/amphiphilic particles VICAL INCORPORATED (US) 2006-06-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110250237-A1 IMMUNOGENIC AMPHIPATHIC PEPTIDE COMPOSITIONS TAP1, TAP2, MICA PRKCA 2094/4885LPAR3 1217/4885LPAR1 1626/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.