SCHEMBL5518358

SCHEMBL5518358

NCCCCC=CCC=CCC=CCC=CCCCCCC(=O)N1CCOCC1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 5/20 0.44
▸ CNR2 P34972 3/20 0.44
▸ GLA P06280 1/20 0.44
▸ KDM4E B2RXH2 3/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ RAB9A P51151 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ USP2 O75604 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ SOAT1 P35610 1/20 0.41
▸ FKBP1A P62942 1/20 0.40

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
SCHEMBL11238446 0.87 GLA (0.56) GLAKDM4EALDH1A1HPGDTDP1
SCHEMBL11543721 0.86 CNR1 (0.59) CNR1CNR2KDM4EALDH1A1HPGD
SCHEMBL31429810 0.82 CNR1 (0.64) CNR1CNR2KDM4EALDH1A1HPGD
SCHEMBL1667911 0.81 L3MBTL1 (0.56) CNR1CNR2GLATDP1RAB9A
SCHEMBL1667902 0.81 L3MBTL1 (0.56) CNR1CNR2GLATDP1RAB9A
SCHEMBL9723841 0.81 GLA (0.54) CNR1GLAKDM4EALDH1A1HPGD
SCHEMBL9723875 0.81 GLA (0.54) CNR1GLAKDM4EALDH1A1HPGD
SCHEMBL9723844 0.81 GLA (0.54) CNR1GLAKDM4EALDH1A1HPGD
SCHEMBL9614171 0.81 GLA (0.54) CNR1GLAKDM4EALDH1A1HPGD
SCHEMBL1447126 0.80 GLA (0.59) GLAKDM4EALDH1A1HPGDRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276613-B1 Retro-anandamides, high affinity and stability cannabinoid receptor ligands UNIVERSITY OF CONNECTICUT (US) 2007-10-02 — — US disclosed
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