SCHEMBL23304908

SCHEMBL23304908

O=C(O)N1CCC2(Cc3cnccc3O2)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPM8 Q7Z2W7 1/20 0.39
▸ EPHX2 P34913 8/20 0.37
▸ CACNA1C Q13936 1/20 0.36
▸ RIPK1 Q13546 1/20 0.34
▸ EPHX1 P07099 1/20 0.34
▸ HDAC3 O15379 2/20 0.34
▸ HDAC4 P56524 2/20 0.34
▸ HDAC1 Q13547 2/20 0.34
▸ HDAC7 Q8WUI4 2/20 0.34
▸ HDAC2 Q92769 2/20 0.34
▸ HDAC10 Q969S8 2/20 0.34
▸ HDAC11 Q96DB2 2/20 0.34
▸ HDAC8 Q9BY41 2/20 0.34
▸ HDAC6 Q9UBN7 2/20 0.34
▸ HDAC9 Q9UKV0 2/20 0.34
▸ HDAC5 Q9UQL6 2/20 0.34
▸ NAMPT P43490 1/20 0.34
▸ GPR119 Q8TDV5 2/20 0.34
▸ CYP2C9 P11712 4/20 0.34
▸ ALDH1A1 P00352 2/20 0.34

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
SCHEMBL23304792 0.83 GPR119 (0.50) NAMPTGPR119
SCHEMBL22495703 0.82 TRPM8 (0.38) TRPM8EPHX2CACNA1CEPHX1HDAC3
SCHEMBL23304802 0.78 DRD2 (0.35) TRPM8EPHX2CACNA1CHDAC3HDAC4
SCHEMBL29634691 0.77 GPR119 (0.54) NAMPTGPR119
SCHEMBL23508661 0.76 KMT2A (0.36) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL19030749 0.74 EPHX2 (0.46) TRPM8EPHX2HDAC3HDAC4HDAC1
SCHEMBL24408866 0.73 GPR119 (0.48) NAMPTGPR119
SCHEMBL29634722 0.72 TRPM8 (0.32) TRPM8EPHX2EPHX1HDAC3HDAC4
SCHEMBL3213563 0.71 SIGMAR1 (0.60) EPHX2EPHX1HDAC3HDAC4HDAC1
SCHEMBL3213557 0.71 SIGMAR1 (0.60) EPHX2EPHX1HDAC3HDAC4HDAC1

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-20230060003-A1 SPIROCYCLIC O-GLYCOPROTEIN-2-ACETAMIDO-2-DEOXY-3-D-GLUCOPYRANOSIDASE INHIBITORS BIOGEN MA INC. 2023-02-23 — — US disclosed
WO-2021086966-A1 SPIROCYCLIC O-GLYCOPROTEIN-2-ACETAMIDO-2-DEOXY-3-D-GLUCOPYRANOSIDASE INHIBITORS BIOGEN MA INC. (US) 2021-05-06 — — 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 (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-20230060003-A1 SPIROCYCLIC O-GLYCOPROTEIN-2-ACETAMIDO-2-DEOXY-3-D-GLUCOPYRANOSIDASE INHIBITORS MAN2A1, MAN2B2, ST6GAL1 TRPM8 3515/4885EPHX2 1011/4885CACNA1C 2122/4885

“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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