SCHEMBL23162452

SCHEMBL23162452

COc1cc(OC)cc(C(C)C(=O)N2C(=O)OC[C@@H]2C(C)C)c1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
IL6ST P40189 5/20 0.48
STAT3 P40763 1/20 0.42
IDH1 O75874 13/20 0.42
PIK3CD O00329 1/20 0.37
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL15515367 1.00 IL6ST (0.48) IL6STSTAT3IDH1PIK3CDKDM4E
SCHEMBL15506109 1.00 IL6ST (0.48) IL6STSTAT3IDH1PIK3CDKDM4E
SCHEMBL17694472 0.93 IL6ST (0.45) IL6STSTAT3IDH1PIK3CD
SCHEMBL3955785 0.85 IL6ST (0.49) IL6STSTAT3IDH1PIK3CD
SCHEMBL3948400 0.85 IL6ST (0.49) IL6STSTAT3IDH1PIK3CD
SCHEMBL3955251 0.85 IL6ST (0.49) IL6STSTAT3IDH1PIK3CD
SCHEMBL3948407 0.85 IL6ST (0.49) IL6STSTAT3IDH1PIK3CD
SCHEMBL9580353 0.85 POLB (0.55) IDH1
SCHEMBL5109568 0.82 IDH1 (0.52) IL6STSTAT3IDH1
SCHEMBL14032396 0.82 IDH1 (0.52) IL6STSTAT3IDH1

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
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

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

For each of this compound's patents that has machine-readable text (2 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 IL6ST 1236/4885STAT3 1489/4885IDH1 2380/4885
US-20210101878-A1 Cannabinergic Compounds And Uses Thereof CNR2, CNR1, GPR18 IL6ST 1236/4885STAT3 1489/4885IDH1 2380/4885

“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.