SCHEMBL21623970

SCHEMBL21623970

CCCCCCCCCCCCC(C)OC(=O)/C=C/C(=O)OC(C)CCCCCCCCCCCC

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.56
CNR1 P21554 1/20 0.54
CNR2 P34972 1/20 0.54
ALDH1A1 P00352 1/20 0.49
NAAA Q02083 1/20 0.44
HCAR2 Q8TDS4 1/20 0.44
LMNA P02545 2/20 0.44
ATM Q13315 1/20 0.44
ACE2 Q9BYF1 1/20 0.43
KDM4E B2RXH2 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
GPR84 Q9NQS5 3/20 0.42
FFAR1 O14842 1/20 0.42
CA1 P00915 1/20 0.42

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
SCHEMBL7064100 1.00 FAAH (0.56) FAAHCNR1CNR2ALDH1A1NAAA
SCHEMBL9149011 1.00 FAAH (0.56) FAAHCNR1CNR2ALDH1A1NAAA
SCHEMBL7064102 1.00 FAAH (0.56) FAAHCNR1CNR2ALDH1A1NAAA
SCHEMBL9153648 1.00 FAAH (0.56) FAAHCNR1CNR2ALDH1A1NAAA
SCHEMBL29382241 0.98 FAAH (0.54) FAAHCNR1CNR2ALDH1A1NAAA
SCHEMBL28343040 0.98 FAAH (0.54) FAAHCNR1CNR2ALDH1A1NAAA
SCHEMBL7949523 0.98 FAAH (0.53) FAAHCNR1CNR2ALDH1A1NAAA
SCHEMBL9153650 0.93 HCAR2 (0.56) FAAHCNR1CNR2ALDH1A1HCAR2
SCHEMBL11750529 0.93 HCAR2 (0.56) FAAHCNR1CNR2ALDH1A1HCAR2
SCHEMBL9150192 0.93 HCAR2 (0.56) FAAHCNR1CNR2ALDH1A1HCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3824060-A1 SOLID FRAGRANCE-CONTAINING COMPOSITION Henkel AG & Co. KGaA (DE) 2021-05-26 EP disclosed
WO-2020015878-A1 SOLID FRAGRANCE-CONTAINING COMPOSITION HENKEL AG & CO. KGAA (DE) 2020-01-23 WO disclosed