SCHEMBL5963776

SCHEMBL5963776

OC(CNCCc1ccc(-c2ccc(Cl)cc2)o1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.54
▸ KDM4E B2RXH2 3/20 0.54
▸ HSD17B10 Q99714 1/20 0.54
▸ NPSR1 Q6W5P4 1/20 0.51
▸ HTT P42858 2/20 0.50
▸ MAPT P10636 1/20 0.50
▸ PKM P14618 1/20 0.50
▸ HPGD P15428 1/20 0.50
▸ GFER P55789 1/20 0.50
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ ADRB2 P07550 3/20 0.45
▸ ADRB3 P13945 6/20 0.44
▸ ADRB1 P08588 4/20 0.44
▸ NPC1 O15118 1/20 0.43
▸ FAAH O00519 1/20 0.42
▸ LMNA P02545 2/20 0.42
▸ USP2 O75604 1/20 0.41

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
SCHEMBL5964603 0.88 ALDH1A1 (0.54) ALDH1A1KDM4EHSD17B10NPSR1HTT
SCHEMBL2298222 0.74 ADRB2 (0.64) KDM4EL3MBTL1ADRB2ADRB3ADRB1
SCHEMBL2292601 0.74 ADRB2 (0.64) KDM4EL3MBTL1ADRB2ADRB3ADRB1
SCHEMBL5963771 0.73 MEN1 (0.46) ALDH1A1KDM4EHSD17B10NPSR1HTT
SCHEMBL6767270 0.73 KMT2A (0.59) KDM4ENPSR1HTTMAPTHPGD
SCHEMBL31073648 0.71 KDM4E (0.52) ALDH1A1KDM4EHSD17B10NPSR1HTT
SCHEMBL31073656 0.71 KDM4E (0.52) ALDH1A1KDM4EHSD17B10NPSR1HTT
SCHEMBL31073650 0.71 KDM4E (0.52) ALDH1A1KDM4EHSD17B10NPSR1HTT
SCHEMBL5964006 0.70 ADRB3 (0.62) ADRB2ADRB3ADRB1
SCHEMBL5964144 0.69 ADRB3 (0.56) ADRB2ADRB3ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060052315-A1 Cb 1/cb 2 receptor ligands and their use in the treatment of pain ASTRAZENECA AB (SE) 2006-03-09 — — US claimed
EP-1594856-A1 CB 1/CB 2 RECEPTOR LIGANDS AND THEIR USE IN THE TREATMENT OF PAIN AstraZeneca AB (SE) 2005-11-16 — — EP claimed
WO-2004060882-A1 CB 1/CB 2 RECEPTOR LIGANDS AND THEIR USE IN THE TREATMENT OF PAIN ASTRAZENECA AB (SE) 2004-07-22 — — WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060052315-A1 Cb 1/cb 2 receptor ligands and their use in the treatment of pain CNR1, CNR2, OPRL1 ALDH1A1 806/4885KDM4E 3936/4885HSD17B10 2668/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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