SCHEMBL23440261

SCHEMBL23440261

CCCCCCCC/C=C\CCCCCCCC(=O)NCC[N+](C)(CCO)CCNC(=O)CCCCCCC/C=C\CCCCCCCC.COS(=O)(=O)[O-]

nearest known ligand 0.58

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3

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 19)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.55
ALDH1A1 P00352 3/20 0.55
HPGD P15428 2/20 0.55
TRPV1 Q8NER1 2/20 0.55
MEN1 O00255 2/20 0.55
BLM P54132 2/20 0.55
KMT2A Q03164 2/20 0.55
MAPT P10636 1/20 0.55
ALOX12 P18054 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
EPHX2 P34913 2/20 0.50
TRPM8 Q7Z2W7 1/20 0.50
FAAH O00519 1/20 0.50
KCNK3 O14649 1/20 0.50
CNR2 P34972 1/20 0.50
SLC6A5 Q9Y345 1/20 0.49
ENPP2 Q13822 1/20 0.48
LPAR1 Q92633 1/20 0.48
LPAR2 Q9HBW0 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
Sulfuric Acid SCHEMBL29001433 0.93 CNR1 (0.60) CNR1ALDH1A1HPGDTRPV1MEN1
SCHEMBL439627 0.93 NAAA (0.46) CNR1ALDH1A1HPGDTRPV1MEN1
SCHEMBL17895349 0.91 EPHX2 (0.52) CNR1ALDH1A1HPGDTRPV1MEN1
SCHEMBL28607116 0.91 EPHX2 (0.52) CNR1ALDH1A1HPGDTRPV1MEN1
SCHEMBL2451376 0.90 CNR1 (0.67) CNR1ALDH1A1HPGDTRPV1MEN1
SCHEMBL29040648 0.84 EPHX2 (0.43) CNR1ALDH1A1HPGDTRPV1MEN1
SCHEMBL28769324 0.84 FAAH (0.47) CNR1ALDH1A1EPHX2FAAHCNR2
SCHEMBL13583973 0.84 FAAH (0.47) CNR1ALDH1A1EPHX2FAAHCNR2
SCHEMBL6673254 0.84 ENPP2 (0.40) TRPV1EPHX2FAAHCNR2ENPP2
SCHEMBL7768310 0.84 ENPP2 (0.40) TRPV1EPHX2FAAHCNR2ENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116084168-A Liquid fabric softener compositions comprising hydroxypropyl starch phosphate and methods of use thereof 诺力昂化学品国际有限公司 2023-05-09 CN claimed
EP-3312336-B1 FABRIC CONDITIONER COMPOSITION AND METHOD OF USE ECOLAB USA INC (US) 2021-06-09 EP claimed
WO-2026087745-A1 AN ANTIOXIDANT COMPOSITION COMPRISING A CINNAMIC ACID DERIVATIVE BRAIN Biotech AG (DE) 2026-04-30 WO disclosed
EP-4732825-A1 AN ANTIOXIDANT COMPOSITION COMPRISING A CINNAMIC ACID DERIVATIVE BRAIN Biotech AG (DE) 2026-04-29 EP disclosed
EP-4096618-B1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS SYMRISE AG (DE) 2025-01-29 EP disclosed
EP-4429465-A1 COMPOSITIONS COMPRISING TRPM8 AGONISTIC COOLING AGENTS Symrise AG (DE) 2024-09-18 EP disclosed
EP-4330265-A1 MICROBIAL GLYCOLIPIDS Analyticon Discovery GmbH (DE) 2024-03-06 EP disclosed
EP-4314220-A1 A LIQUID DETERGENT COMPOSITION Symrise AG (DE) 2024-02-07 EP disclosed
EP-4301833-A1 TOILET RIM BLOCKS WITH SCENT CHANGE Symrise AG (DE) 2024-01-10 EP disclosed
EP-4259287-A1 A METHOD FOR FIGHTING MICROORGANISMS USING MENTHOL DERIVATIVES Symrise AG (DE) 2023-10-18 EP disclosed
WO-2023083445-A1 COMPOSITIONS COMPRISING TRPM8 AGONISTIC COOLING AGENTS SYMRISE AG (DE) 2023-05-19 WO disclosed
EP-4149919-A1 A FRAGRANCE COMPOSITION Symrise AG (DE) 2023-03-22 EP disclosed
CN-110573140-B Active agent-containing articles 宝洁公司 2023-02-03 CN disclosed
WO-2022233623-A1 MICROBIAL GLYCOLIPIDS ANALYTICON DISCOVERY GMBH (DE) 2022-11-10 WO disclosed
WO-2022199790-A1 A LIQUID DETERGENT COMPOSITION SYMRISE AG (DE) 2022-09-29 WO disclosed
WO-2022184247-A1 TOILET RIM BLOCKS WITH SCENT CHANGE SYMRISE AG (DE) 2022-09-09 WO disclosed
EP-4025675-A1 A PERFUME OIL MIXTURE Symrise AG (DE) 2022-07-13 EP disclosed
WO-2022122144-A1 A METHOD FOR FIGHTING MICROORGANISMS USING MENTHOL DERIVATIVES SYMRISE AG (DE) 2022-06-16 WO disclosed
WO-2022111829-A1 ESSENTIAL OILS OF CITRUS FRUITS FOR USE AS MEDICAMENT FOR INDUCED, INCREASED AND/OR ACCELERATED AUTOPHAGY IN HUMAN KERATINOCYTES SYMRISE AG (DE) 2022-06-02 WO disclosed