SCHEMBL851584

SCHEMBL851584

CCCCCCCCCC(=O)N[C@@H](CCC(=O)[O-])C(=O)O.[Na+]

nearest known ligand 0.75

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 12)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 11/20 0.75
SLC6A5 Q9Y345 2/20 0.56
FAAH O00519 2/20 0.51
MEN1 O00255 1/20 0.51
MAPK1 P28482 1/20 0.51
KMT2A Q03164 1/20 0.51
GPR84 Q9NQS5 1/20 0.51
PLA2G2C Q5R387 1/20 0.50
CPT2 P23786 1/20 0.49
CPT1A P50416 1/20 0.49
CPT1B Q92523 1/20 0.49
EPHX2 P34913 1/20 0.48

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
SCHEMBL19717680 1.00 NOD1 (0.75) NOD1SLC6A5FAAHMEN1MAPK1
SCHEMBL26997839 1.00 NOD1 (0.75) NOD1SLC6A5FAAHMEN1MAPK1
SCHEMBL333310 1.00 NOD1 (0.75) NOD1SLC6A5FAAHMEN1MAPK1
SCHEMBL93869 1.00 NOD1 (0.75) NOD1SLC6A5FAAHMEN1MAPK1
SCHEMBL322950 1.00 NOD1 (0.75) NOD1SLC6A5FAAHMEN1MAPK1
SCHEMBL29326 1.00 NOD1 (0.75) NOD1SLC6A5FAAHMEN1MAPK1
SCHEMBL17204500 1.00 NOD1 (0.75) NOD1SLC6A5FAAHMEN1MAPK1
SCHEMBL1899588 1.00 NOD1 (0.75) NOD1SLC6A5FAAHMEN1MAPK1
SCHEMBL284836 1.00 NOD1 (0.75) NOD1SLC6A5FAAHMEN1MAPK1
SCHEMBL414654 0.98 NOD1 (0.73) NOD1SLC6A5FAAHMEN1MAPK1

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 163 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2263643-A2 Anti-wrinkle cosmetic product comprising plant extracts Henkel AG & Co. KGaA (DE) 2010-12-22 EP claimed
EP-2243464-A2 Skin treatment fighting skin aging I Henkel AG & Co. KGaA (DE) 2010-10-27 EP claimed
EP-1393518-B1 ARYLSULFATASE-INHIBITORS IN DEODORANTS AND ANTIPERSPIRANTS HENKEL AG & CO KGAA (DE) 2010-03-17 EP claimed
EP-1949887-A2 Cosmetic formulas for skin smoothing and tautening Henkel AG & Co. KGaA (DE) 2008-07-30 EP claimed
EP-1938789-A1 Improvement of the skin friendliness of hyperemizing agents Henkel AG & Co. KGaA (DE) 2008-07-02 EP claimed
EP-1815843-A2 Synergistic protein hydrolysate combinations for treating mature skin Henkel KGaA (DE) 2007-08-08 EP claimed
EP-1800119-A2 COSMETIC AND DERMATOLOGICAL COMPOSITIONS CONTAINING ACTIVE SUBSTANCES FOR IMPROVING SENSORY PERCEPTION HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-06-27 EP claimed
EP-1776087-A1 COSMETIC AND DERMATOLOGICAL COMPOSITIONS COMPRISING (2-HYDROXYETHYL)UREA HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-04-25 EP claimed
WO-2006042627-A2 COSMETIC AND DERMATOLOGICAL COMPOSITIONS CONTAINING ACTIVE SUBSTANCES FOR IMPROVING SENSORY PERCEPTION HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-04-27 WO claimed
EP-1640041-A2 Cosmetic and dermatological composition for the treatment of aging or photodamaged skin Henkel Kommanditgesellschaft auf Aktien (DE) 2006-03-29 EP claimed
WO-2006018198-A1 COSMETIC AND DERMATOLOGICAL COMPOSITIONS COMPRISING (2-HYDROXYETHYL)UREA HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-02-23 WO claimed
EP-1430933-A2 Cosmetic and pharmaceutical compositions comprising steroid sulfatase inhibitors and their use for the reduction of hair loss Henkel Kommanditgesellschaft auf Aktien (DE) 2004-06-23 EP claimed
EP-1428519-A2 5-Lipooxygenase inhibitors in deodorants and antiperspirants Henkel Kommanditgesellschaft auf Aktien (DE) 2004-06-16 EP claimed
EP-1428520-A2 Lipase inhibitors in deodorants and antiperspirants Henkel Kommanditgesellschaft auf Aktien (DE) 2004-06-16 EP claimed
EP-1393518-A2 ARYLSULFATASE-INHIBITORS IN DEODORANTS AND ANTIPERSPIRANTS Henkel Kommanditgesellschaft auf Aktien (DE) 2004-03-03 EP claimed
WO-2001099376-A2 ARYLSULFATASE-INHIBITORS IN DEODORANTS AND ANTIPERSPIRANTS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-12-27 WO claimed
US-20250367295-A1 FAST-ACTING PLANT-BASED MEDICINAL COMPOUNDS AND NUTRITIONAL SUPPLEMENTS SPOKE SCIENCES, INC. (US) 2025-12-04 US disclosed
EP-3928776-B1 FAST-ACTING PLANT-BASED MEDICINAL COMPOUNDS AND NUTRITIONAL SUPPLEMENTS SPOKE SCIENCES INC (US) 2025-11-12 EP disclosed
WO-2003097005-A1 HIGHLY FOAMING CLEANSING GEL CONTAINING ACYLAMINO ACID SURFACTANTS BEIERSDORF AG (DE) 2003-11-27 WO disclosed
WO-2001099376-A2 ARYLSULFATASE-INHIBITORS IN DEODORANTS AND ANTIPERSPIRANTS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-12-27 WO 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-20250367295-A1 FAST-ACTING PLANT-BASED MEDICINAL COMPOUNDS AND NUTRITIONAL SUPPLEMENTS SLC1A5, SLC43A1, SLC27A2 NOD1 3604/4885SLC6A5 309/4885FAAH 250/4885

“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.