SCHEMBL8345503

SCHEMBL8345503

CCCCCCCCCCCCCCCCCC(=O)C(O)(C(=O)CCCCCCCCCCCCCCC)C(O)CO

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 8/20 0.50
CES1 P23141 5/20 0.50
CES2 O00748 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
CYP1A2 P05177 1/20 0.50
HSD17B10 Q99714 1/20 0.50
KDM4E B2RXH2 1/20 0.45
DUSP3 P51452 1/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44

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
SCHEMBL14989523 1.00 FAAH (0.50) FAAHCES1CES2MEN1KMT2A
SCHEMBL1340804 1.00 FAAH (0.50) FAAHCES1CES2MEN1KMT2A
SCHEMBL9503018 1.00 FAAH (0.50) FAAHCES1CES2MEN1KMT2A
Octane SCHEMBL16440085 1.00 FAAH (0.50) FAAHCES1CES2MEN1KMT2A
SCHEMBL440982 1.00 FAAH (0.50) FAAHCES1CES2MEN1KMT2A
SCHEMBL1066766 1.00 FAAH (0.50) FAAHCES1CES2MEN1KMT2A
SCHEMBL2016841 1.00 FAAH (0.50) FAAHCES1CES2MEN1KMT2A
SCHEMBL1517931 1.00 FAAH (0.50) FAAHCES1CES2MEN1KMT2A
SCHEMBL571427 1.00 FAAH (0.50) FAAHCES1CES2MEN1KMT2A
SCHEMBL136430 1.00 FAAH (0.50) FAAHCES1CES2MEN1KMT2A

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
CN-118909698-A Method for simultaneously extracting water-soluble and fat-soluble essential oil of peony 三门峡牡仙生物科技有限公司 2024-11-08 CN claimed
CN-119280161-A Gefitinib liposome complex and preparation method thereof 恩康药业科技(广州)有限公司 2025-01-10 CN disclosed
CN-118909698-A Method for simultaneously extracting water-soluble and fat-soluble essential oil of peony 三门峡牡仙生物科技有限公司 2024-11-08 CN disclosed
CN-109077997-B Pemetrexed disodium lipid compound and preparation method thereof 恩康药业科技(广州)有限公司 2023-04-07 CN disclosed
CN-109077998-B Salmeterol lipid complex and preparation method thereof 恩康药业科技(广州)有限公司 2023-02-03 CN disclosed
US-5856196-A RESPIRATORY SYSTEM DISORDERS BETH ISRAEL HOSPITAL (US) 1999-01-05 US disclosed