SCHEMBL23975221

SCHEMBL23975221

C[C@H](NC(=O)CNC(=O)c1cccc(Cl)c1)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR139 Q6DWJ6 19/20 1.00
MEN1 O00255 1/20 1.00
KMT2A Q03164 1/20 1.00
ATM Q13315 1/20 1.00

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
SCHEMBL30518967 1.00 GPR139 (1.00) GPR139MEN1KMT2AATM
SCHEMBL12443252 0.85 GPR139 (0.74) GPR139MEN1KMT2AATM
SCHEMBL2010690 0.84 SLC6A9 (0.83) GPR139MEN1KMT2AATM
SCHEMBL23975012 0.83 GPR139 (1.00) GPR139MEN1KMT2AATM
SCHEMBL10340670 0.81 GPR139 (0.78) GPR139MEN1KMT2AATM
SCHEMBL4801790 0.77 PSMB5 (0.70) GPR139MEN1KMT2AATM
SCHEMBL10004955 0.77 KMT2A (0.62) GPR139MEN1KMT2AATM
SCHEMBL8858800 0.77 KMT2A (0.61) GPR139MEN1KMT2AATM
SCHEMBL17847355 0.77 KMT2A (0.78) GPR139MEN1KMT2AATM
SCHEMBL2984329 0.76 KMT2A (0.60) GPR139MEN1KMT2AATM

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
WO-2023165262-A1 THIENO-NITROGEN-CONTAINING HETEROCYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, PREPARATION METHOD THEREFOR, AND USE THEREOF 上海科技大学 2023-09-07 WO disclosed
WO-2023165263-A1 PYRROLOTRIAZINONE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, PREPARATION METHOD THEREFOR, AND USE THEREOF 上海科技大学 2023-09-07 WO disclosed
US-20210338680-A1 METHODS RELATED TO OPIOID THERAPEUTICS THE SCRIPPS RESEARCH INSTITUTE (US) 2021-11-04 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 (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-20210338680-A1 METHODS RELATED TO OPIOID THERAPEUTICS OPRL1, OPRK1, GPR139 GPR139 3/4885MEN1 4873/4885KMT2A 1691/4885

“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.