SCHEMBL23216813

SCHEMBL23216813

CC(C)(C)OC(=O)N1CCC(c2c(O)cccc2Cl)CC1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
STS P08842 3/20 0.57
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
MAPT P10636 3/20 0.49
GPR119 Q8TDV5 2/20 0.49
LMNA P02545 2/20 0.48
TP53 P04637 1/20 0.48
KDM4E B2RXH2 1/20 0.48
THRB P10828 1/20 0.48
PTPN2 P17706 1/20 0.48
PTPN1 P18031 1/20 0.48
PTPN6 P29350 1/20 0.48
NAMPT P43490 1/20 0.47
USP2 O75604 1/20 0.46
HPGD P15428 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL29886235 1.00 STS (0.57) STSMEN1KMT2AMAPTGPR119
SCHEMBL2160640 0.81 MEN1 (0.57) STSMEN1KMT2AMAPTGPR119
SCHEMBL29768360 0.81 MAPT (0.46) STSMEN1KMT2AMAPTGPR119
SCHEMBL23216742 0.81 MAPT (0.46) STSMEN1KMT2AMAPTGPR119
SCHEMBL23780156 0.80 STS (0.57) STSMEN1KMT2AMAPTGPR119
SCHEMBL24947192 0.80 GPR119 (0.51) STSMAPTGPR119KDM4ETHRB
SCHEMBL31321884 0.80 GPR119 (0.51) STSMAPTGPR119KDM4ETHRB
SCHEMBL1613087 0.79 GPR119 (0.56) STSMAPTGPR119TP53KDM4E
SCHEMBL28812695 0.79 GPR119 (0.54) STSMEN1KMT2AMAPTGPR119
SCHEMBL22609011 0.79 STS (0.47) STSMEN1KMT2AMAPTGPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230026611-A1 ARYL HETEROCYCLIC COMPOUNDS AS Kv1.3 POTASSIUM SHAKER CHANNEL BLOCKERS D. E. SHAW RESEARCH, LLC 2023-01-26 US disclosed
EP-4041407-A1 ARYL HETEROCYCLIC COMPOUNDS AS KV1.3 POTASSIUM SHAKER CHANNEL BLOCKERS D.E. Shaw Research, LLC (US) 2022-08-17 EP disclosed
WO-2021071802-A1 ARYL HETEROCYCLIC COMPOUNDS AS KV1.3 POTASSIUM SHAKER CHANNEL BLOCKERS D. E. SHAW RESEARCH, LLC (US) 2021-04-15 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-20230026611-A1 ARYL HETEROCYCLIC COMPOUNDS AS Kv1.3 POTASSIUM SHAKER CHANNEL BLOCKERS KCNA3, KCNH2, KCNJ2 STS 573/4885MEN1 1734/4885KMT2A 388/4885

“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.