SCHEMBL21467223

SCHEMBL21467223

CC(=O)N1C2CCC1CC(c1ccc(C(C)(C)C)cc1)C2

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 2/20 0.46
▸ OPRD1 P41143 2/20 0.46
▸ HSD11B1 P28845 8/20 0.43
▸ LIPE Q05469 1/20 0.40
▸ ACACB O00763 1/20 0.39
▸ SLC6A2 P23975 1/20 0.39
▸ RIPK1 Q13546 1/20 0.39
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ MGLL Q99685 1/20 0.37
▸ TP53 P04637 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
SCHEMBL21467224 0.86 CNR2 (0.52) —
SCHEMBL18711267 0.81 SLC18A3 (0.50) OPRM1
SCHEMBL15317735 0.79 HSD11B1 (0.49) OPRM1OPRD1HSD11B1LIPE
SCHEMBL23252280 0.79 SLC6A3 (0.44) MGLL
SCHEMBL18701837 0.75 RIPK1 (0.53) OPRM1OPRD1RIPK1
SCHEMBL4402414 0.75 QDPR (0.59) LIPEMEN1KMT2ATP53
SCHEMBL4402400 0.74 ACACB (0.48) LIPEACACBSLC6A2RIPK1MEN1
SCHEMBL15317720 0.74 HSD11B1 (0.51) OPRM1OPRD1HSD11B1SLC6A2
SCHEMBL15317719 0.74 HSD11B1 (0.51) OPRM1OPRD1HSD11B1SLC6A2
SCHEMBL15317744 0.73 CNR2 (0.43) OPRM1OPRD1HSD11B1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912659-B2 EBNA1 inhibitors and methods using same THE WISTAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2024-02-27 — — US disclosed
US-11912659-B2 EBNA1 inhibitors and methods using same THE WISTAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2024-02-27 — — US disclosed
US-10981867-B2 EBNA1 inhibitors and methods using same THE WISTAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2021-04-20 — — US disclosed
US-20200239415-A1 EBNA1 INHIBITORS AND METHODS USING SAME WISTAR INST (US) 2020-07-30 — — US disclosed
US-10442763-B2 EBNA1 inhibitors and methods using same THE WISTAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2019-10-15 — — 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 (4 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-20200239415-A1 EBNA1 INHIBITORS AND METHODS USING SAME MLLT1, EBNA1BP2, MALT1 OPRM1 4871/4885OPRD1 4883/4885HSD11B1 2001/4885
US-10981867-B2 EBNA1 inhibitors and methods using same MLLT1, EBNA1BP2, MALT1 OPRM1 4871/4885OPRD1 4883/4885HSD11B1 2001/4885
US-11912659-B2 EBNA1 inhibitors and methods using same MLLT1, EBNA1BP2, MALT1 OPRM1 4871/4885OPRD1 4883/4885HSD11B1 2001/4885
US-10442763-B2 EBNA1 inhibitors and methods using same MLLT1, EBNA1BP2, MALT1 OPRM1 4871/4885OPRD1 4883/4885HSD11B1 2001/4885

“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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