SCHEMBL23611543

SCHEMBL23611543

CC(C)(C)OC(=O)N1C2CCC(O)C1c1ccccc12

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.42
CHRM1 P11229 2/20 0.42
CHRM3 P20309 2/20 0.42
GPR119 Q8TDV5 2/20 0.40
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39
HSD11B1 P28845 1/20 0.39
ABCB1 P08183 1/20 0.38
STS P08842 2/20 0.37
KDM1A O60341 2/20 0.37
NAMPT P43490 1/20 0.37
BCHE P06276 1/20 0.37
TERT O14746 1/20 0.36
PDK2 Q15119 1/20 0.35
PREP P48147 1/20 0.35
CHRM4 P08173 1/20 0.35

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
SCHEMBL29987921 0.88 GPR119 (0.44) CHRM2CHRM1CHRM3GPR119KDM4E
SCHEMBL29987914 0.88 GPR119 (0.44) CHRM2CHRM1CHRM3GPR119KDM4E
SCHEMBL29987993 0.88 GPR119 (0.44) CHRM2CHRM1CHRM3GPR119KDM4E
SCHEMBL13137753 0.87 GPR119 (0.47) CHRM2CHRM1CHRM3GPR119KDM4E
Hydrochloric Acid SCHEMBL30041068 0.86 GPR119 (0.46) CHRM2CHRM1CHRM3GPR119KDM4E
SCHEMBL29987990 0.85 GPR119 (0.40) CHRM2CHRM1CHRM3GPR119KDM4E
SCHEMBL23611614 0.84 CHRM2 (0.40) CHRM2CHRM1CHRM3GPR119KDM4E
SCHEMBL23611599 0.78 FFAR2 (0.37)
SCHEMBL23611561 0.77 DDB1 (0.41) CHRM2CHRM1CHRM3GPR119KDM4E
SCHEMBL29987892 0.76 GPR119 (0.39) CHRM2CHRM1CHRM3GPR119KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118324762-A Compounds and compositions for treating CNS disorders 布鲁奥科制药有限公司 2024-07-12 CN disclosed
US-20230116114-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CNS DISORDERS BLUE OAK PHARMACEUTICALS, INC. 2023-04-13 US disclosed
EP-4084797-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CNS DISORDERS Blue Oak Pharmaceuticals, Inc. (US) 2022-11-09 EP disclosed
WO-2021138314-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CNS DISORDERS BLUE OAK PHARMACEUTICALS, INC. (US) 2021-07-08 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-20230116114-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CNS DISORDERS PMP22, CHAT, ACHE CHRM2 141/4885CHRM1 330/4885CHRM3 97/4885

“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.