SCHEMBL21801484

SCHEMBL21801484

CCCCCCCCCCCCOC(=O)C(C(=O)O)(C(=O)O)C(CC)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.45
NAAA Q02083 1/20 0.43
EPHX1 P07099 1/20 0.41
HSPD1 P10809 1/20 0.41
BLM P54132 1/20 0.41
HSPE1 P61604 1/20 0.41
MEN1 O00255 1/20 0.40
HPGD P15428 1/20 0.40
RECQL P46063 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TSHR P16473 3/20 0.40
HTR2C P28335 1/20 0.40
RAD52 P43351 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
FAAH O00519 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
ATM Q13315 1/20 0.37
ACHE P22303 3/20 0.37

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
SCHEMBL8830168 1.00 HCAR2 (0.45) HCAR2NAAAEPHX1HSPD1BLM
SCHEMBL23152436 1.00 HCAR2 (0.45) HCAR2NAAAEPHX1HSPD1BLM
SCHEMBL29184935 0.98 HCAR2 (0.44) HCAR2NAAAEPHX1HSPD1BLM
SCHEMBL2761368 0.97 HCAR2 (0.45) HCAR2NAAAEPHX1HSPD1BLM
SCHEMBL29740120 0.97 HCAR2 (0.45) HCAR2NAAAEPHX1HSPD1BLM
SCHEMBL11692844 0.90 ATM (0.43) HCAR2NAAAEPHX1HSPD1BLM
SCHEMBL4968326 0.84 CES2 (0.45) HCAR2NAAAHSPD1BLMHSPE1
SCHEMBL21801482 0.82 NAAA (0.47) HCAR2NAAAEPHX1TSHRHTR2C
SCHEMBL23152434 0.82 NAAA (0.47) HCAR2NAAAEPHX1TSHRHTR2C
SCHEMBL8830167 0.82 NAAA (0.47) HCAR2NAAAEPHX1TSHRHTR2C

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
WO-2024110023-A1 AN ACTIVE COMPOSITION COMPRISING RETINOL SYMRISE AG (DE) 2024-05-30 WO disclosed
WO-2024078679-A1 A FRAGRANCE MIXTURE (VI) SYMRISE AG (DE) 2024-04-18 WO disclosed
WO-2024051922-A1 A FRAGRANCE MIXTURE (III) SYMRISE AG (DE) 2024-03-14 WO disclosed
EP-4326251-A1 COMPOSITIONS COMPRISING CANNABIDIOL AND, OPTIONALLY, BISABOLOL Symrise AG (DE) 2024-02-28 EP disclosed
WO-2024037712-A1 1-CYCLOOCTYLPROPAN-2-ONE AS A FRAGRANCE SYMRISE AG (DE) 2024-02-22 WO disclosed
WO-2024027922-A1 A FRAGRANCE MIXTURE (II) SYMRISE AG (DE) 2024-02-08 WO disclosed
EP-4291154-A1 MEDICAMENT FOR PREVENTION AND TREATMENT OF HYPERPIGMENTATION Symrise AG (DE) 2023-12-20 EP disclosed
WO-2023232245-A1 FRAGRANCES WITH CYCLOPROPYL STRUCTURE SYMRISE AG (DE) 2023-12-07 WO disclosed
WO-2023232243-A1 A FRAGRANCE MIXTURE (V) SYMRISE AG (DE) 2023-12-07 WO disclosed
WO-2023232242-A1 FRAGRANCE MIXTURE SYMRISE AG (DE) 2023-12-07 WO disclosed
WO-2023213386-A1 A FRAGRANCE MIXTURE (V) SYMRISE AG (DE) 2023-11-09 WO disclosed
WO-2023160805-A1 FRAGRANCES WITH METHOXY ACETATE STRUCTURE SYMRISE AG (DE) 2023-08-31 WO disclosed
WO-2023147874-A1 A FRAGRANCE MIXTURE SYMRISE AG (DE) 2023-08-10 WO disclosed
WO-2023088551-A1 FRAGRANCES AND FRAGRANCE MIXTURES SYMRISE AG (DE) 2023-05-25 WO disclosed
EP-3849505-A1 A HAIR CARE COMPOSITION Symrise AG (DE) 2021-07-21 EP disclosed
WO-2021104645-A1 RIM BLOCK WITH IMPROVED SCENT PERFORMANCE SYMRISE AG (DE) 2021-06-03 WO disclosed
WO-2021073775-A1 ARTICLES FOR INDIRECT TRANSFER OF COSMETIC ACTIVES TO SKIN SYMRISE AG (DE) 2021-04-22 WO disclosed
WO-2020192865-A1 PLANT PEPTIDES AND THEIR APPLICATIONS SYMRISE AG (DE) 2020-10-01 WO disclosed
WO-2020052778-A1 A HAIR CARE COMPOSITION SYMRISE AG (DE) 2020-03-19 WO disclosed