SCHEMBL2114177

SCHEMBL2114177

CC(C)(C)OC(=O)N1C[C@H]2CC[C@@H](O)[C@H]2C1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.53
USP2 O75604 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
RECQL P46063 1/20 0.42
CHRM2 P08172 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
HPGD P15428 1/20 0.41
PREP P48147 3/20 0.40
USP30 Q70CQ3 1/20 0.40
GPR119 Q8TDV5 3/20 0.40
EPHX1 P07099 1/20 0.39
DDB1 Q16531 1/20 0.39
CRBN Q96SW2 1/20 0.39

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
SCHEMBL31670249 1.00 NR1H2 (0.53) NR1H2USP2SMN1; SMN2RECQLCHRM2
SCHEMBL20031547 1.00 NR1H2 (0.53) NR1H2USP2SMN1; SMN2RECQLCHRM2
SCHEMBL8254856 1.00 NR1H2 (0.53) NR1H2USP2SMN1; SMN2RECQLCHRM2
SCHEMBL22398001 1.00 NR1H2 (0.53) NR1H2USP2SMN1; SMN2RECQLCHRM2
Bicarbonate SCHEMBL30861201 0.94 NR1H2 (0.48) NR1H2USP2SMN1; SMN2RECQLCHRM2
SCHEMBL19779324 0.91 NR1H2 (0.50) NR1H2USP2SMN1; SMN2RECQLCHRM2
SCHEMBL21480200 0.91 NR1H2 (0.50) NR1H2USP2SMN1; SMN2RECQLCHRM2
SCHEMBL19779325 0.91 NR1H2 (0.50) NR1H2USP2SMN1; SMN2RECQLCHRM2
SCHEMBL19818365 0.89 NR1H2 (0.46) NR1H2USP2SMN1; SMN2RECQLCHRM2
SCHEMBL16080285 0.89 NR1H2 (0.50) NR1H2USP2SMN1; SMN2RECQLCHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230331725-A1 COMPOUNDS FOR TREATING HUNTINGTON'S DISEASE PTC THERAPEUTICS, INC. 2023-10-19 US disclosed
US-20230331725-A1 COMPOUNDS FOR TREATING HUNTINGTON'S DISEASE PTC THERAPEUTICS, INC. 2023-10-19 US disclosed
US-20230331725-A1 COMPOUNDS FOR TREATING HUNTINGTON'S DISEASE PTC THERAPEUTICS, INC. 2023-10-19 US disclosed
US-11780839-B2 Compounds for treating Huntington's disease PTC THERAPEUTICS, INC. (US) 2023-10-10 US disclosed
US-11780839-B2 Compounds for treating Huntington's disease PTC THERAPEUTICS, INC. (US) 2023-10-10 US disclosed
US-11780839-B2 Compounds for treating Huntington's disease PTC THERAPEUTICS, INC. (US) 2023-10-10 US disclosed
US-20210024525-A1 COMPOUNDS FOR TREATING HUNTINGTON'S DISEASE PTC THERAPEUTICS, INC. 2021-01-28 US disclosed
CN-112203653-A Compounds for the treatment of huntington's disease PTC医疗公司 2021-01-08 CN disclosed
US-20120095040-A1 CYCLOPENTA[C]PYRROLE-2-CARBOXYLATE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-04-19 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-20210024525-A1 COMPOUNDS FOR TREATING HUNTINGTON'S DISEASE HTT, HYPK, HDAC6 NR1H2 417/4885USP2 2318/4885SMN1; SMN2 84/4885
US-20120095040-A1 CYCLOPENTA[C]PYRROLE-2-CARBOXYLATE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF EPOR, ACAD9, CBR1 NR1H2 997/4885USP2 4775/4885SMN1; SMN2 2003/4885
US-20230331725-A1 COMPOUNDS FOR TREATING HUNTINGTON'S DISEASE HTT, HYPK, HDAC6 NR1H2 417/4885USP2 2318/4885SMN1; SMN2 84/4885
US-11780839-B2 Compounds for treating Huntington's disease HTT, HYPK, HDAC6 NR1H2 417/4885USP2 2318/4885SMN1; SMN2 84/4885

“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.