SCHEMBL15517365

SCHEMBL15517365

CCOC(=O)C(C)(C)c1cc(O)c(-c2cccc(C#N)c2)c(O)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 9/20 1.00
▸ FNTA P49354 1/20 0.46
▸ FNTB P49356 1/20 0.46
▸ CNR1 P21554 2/20 0.46
▸ PDCD1 Q15116 1/20 0.42
▸ CD274 Q9NZQ7 1/20 0.42
▸ XDH P47989 1/20 0.41
▸ SLC22A12 Q96S37 1/20 0.41
▸ HRH2 P25021 1/20 0.41
▸ HRH1 P35367 1/20 0.41
▸ EGLN1 Q9GZT9 1/20 0.41
▸ TLR8 Q9NR97 1/20 0.40
▸ TLR7 Q9NYK1 1/20 0.40
▸ ADORA2A P29274 1/20 0.38
▸ GABRG2 P18507 1/20 0.38
▸ GABRB3 P28472 1/20 0.38
▸ GABRA5 P31644 1/20 0.38
▸ GABRA3 P34903 1/20 0.38
▸ SGK1 O00141 1/20 0.38
▸ USP7 Q93009 1/20 0.38

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
SCHEMBL15515039 0.86 CNR2 (0.76) CNR2FNTAFNTBCNR1PDCD1
SCHEMBL17694501 0.84 CNR2 (0.73) CNR2FNTAFNTBCNR1PDCD1
SCHEMBL5783107 0.82 CNR2 (0.70) CNR2FNTAFNTBPDCD1CD274
SCHEMBL23198621 0.76 CNR2 (0.71) CNR2FNTAFNTBCNR1
SCHEMBL23198601 0.76 CNR2 (0.79) CNR2FNTAFNTBCNR1
SCHEMBL15515950 0.76 CNR2 (1.00) CNR2CNR1
SCHEMBL15515752 0.75 CNR2 (1.00) CNR2CNR1
SCHEMBL15609391 0.74 CNR2 (0.57) CNR2HRH2HRH1
SCHEMBL18982084 0.71 CNR2 (0.55) CNR2FNTAFNTBPDCD1CD274
SCHEMBL1549698 0.70 PPARA (0.57) CNR2PDCD1CD274HRH2HRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11964956-B2 Cannabinergic compounds and uses thereof NORTHEASTERN UNIVERSITY (US) 2024-04-23 — — US disclosed
US-20210101878-A1 Cannabinergic Compounds And Uses Thereof NORTHEASTERN UNIVERSITY 2021-04-08 — — US disclosed
US-10882838-B2 Cannabinergic compounds and uses thereof NORTHEASTERN UNIVERSITY (US) 2021-01-05 — — US disclosed
US-10882838-B2 Cannabinergic compounds and uses thereof NORTHEASTERN UNIVERSITY (US) 2021-01-05 — — US disclosed
US-20190185443-A1 Novel Cannabinergic Compounds And Uses Thereof NORTHEASTERN UNIVERSITY 2019-06-20 — — US disclosed
US-20190185443-A1 Novel Cannabinergic Compounds And Uses Thereof NORTHEASTERN UNIVERSITY 2019-06-20 — — US disclosed
US-20160108016-A1 Novel Cannabinergic Compounds and Uses Thereof NORTHEASTERN UNIVERSITY (US) 2016-04-21 — — US disclosed
US-20160108016-A1 Novel Cannabinergic Compounds and Uses Thereof NORTHEASTERN UNIVERSITY (US) 2016-04-21 — — US disclosed
US-20160108016-A1 Novel Cannabinergic Compounds and Uses Thereof NORTHEASTERN UNIVERSITY (US) 2016-04-21 — — US disclosed
WO-2014039042-A1 NOVEL CANNABINERGIC COMPOUNDS AND USES THEREOF NORTHEASTERN UNIVERSITY (US) 2014-03-13 — — WO disclosed

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

For each of this compound's patents that has machine-readable text (5 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-11964956-B2 Cannabinergic compounds and uses thereof CNR2, CNR1, GPR18 CNR2 1/4885FNTA 1645/4885FNTB 3658/4885
US-20190185443-A1 Novel Cannabinergic Compounds And Uses Thereof CNR2, CNR1, GPR18 CNR2 1/4885FNTA 1937/4885FNTB 3694/4885
US-10882838-B2 Cannabinergic compounds and uses thereof CNR2, CNR1, GPR18 CNR2 1/4885FNTA 1645/4885FNTB 3658/4885
US-20210101878-A1 Cannabinergic Compounds And Uses Thereof CNR2, CNR1, GPR18 CNR2 1/4885FNTA 1645/4885FNTB 3658/4885
US-20160108016-A1 Novel Cannabinergic Compounds and Uses Thereof CNR2, CNR1, GPR18 CNR2 1/4885FNTA 1937/4885FNTB 3694/4885

“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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