SCHEMBL6994594

SCHEMBL6994594

CC(C)(C)OC(=O)N1CCNC(c2ccc(Cl)c(Cl)c2)C1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.42
STS P08842 1/20 0.41
PDE4B Q07343 2/20 0.41
MAPK1 P28482 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ESR2 Q92731 1/20 0.39
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
OPRK1 P41145 1/20 0.38
RORC P51449 1/20 0.37
TACR3 P29371 1/20 0.37
KDM1A O60341 1/20 0.37
CCR2 P41597 1/20 0.37
KCNH2 Q12809 1/20 0.37

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
SCHEMBL3318358 0.87 MEN1 (0.49) STSPDE4BMAPK1MEN1KMT2A
SCHEMBL30397321 0.85 STS (0.47) GSK3BSTSMAPK1MEN1KMT2A
SCHEMBL23982238 0.85 STS (0.47) GSK3BSTSMAPK1MEN1KMT2A
SCHEMBL16640402 0.84 DPP4 (0.43) PDE4BMAPK1KDM4EMAPTTHRB
SCHEMBL26102356 0.83 GPR119 (0.49) PDE4BMAPK1MEN1KMT2AMAPT
SCHEMBL6017253 0.83 GPR119 (0.49) PDE4BMAPK1MEN1KMT2AMAPT
SCHEMBL16026535 0.83 ESR2 (0.44) PDE4BMAPK1KMT2AESR2KDM4E
SCHEMBL38662218 0.83 MEN1 (0.47) PDE4BMAPK1MEN1KMT2ARORC
SCHEMBL31223989 0.82 KDM4E (0.39) STSPDE4BMAPK1MEN1KMT2A
SCHEMBL17519223 0.82 RORC (0.44) GSK3BPDE4BMAPK1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240270705-A1 COMPOUNDS SELECTIVE FOR JAK1 AND METHODS OF USE VIVIDION THERAPEUTICS, INC. 2024-08-15 US disclosed
WO-2022251280-A1 COMPOUNDS SELECTIVE FOR JAK1 AND METHODS OF USE VIVIDION THERAPEUTICS, INC. (US) 2022-12-01 WO disclosed
EP-0823906-B1 PIPERAZINO DERIVATIVES AS NEUROKININ ANTAGONISTS SCHERING CORP (US) 2003-07-09 EP disclosed
US-5981520-A USEFUL FOR TREATING ASTHMA, BRONCHOSPASM, ALLERGIES, ANXIETY, COUGHING OR PAIN SCHERING CORPORATION (US) 1999-11-09 US disclosed
US-5795894-A TREATMENT OF ASTHMA AND BRONCHOSPASM SCHERING CORPORATION (US) 1998-08-18 US disclosed
EP-0823906-A1 PIPERAZINO DERIVATIVES AS NEUROKININ ANTAGONISTS SCHERING CORPORATION (US) 1998-02-18 EP disclosed
WO-1996034864-A1 PIPERAZINO DERIVATIVES AS NEUROKININ ANTAGONISTS SCHERING CORPORATION (US) 1996-11-07 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-20240270705-A1 COMPOUNDS SELECTIVE FOR JAK1 AND METHODS OF USE JAK2, JAK1, JAK3 GSK3B 529/4885STS 4352/4885PDE4B 1223/4885

“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.