SCHEMBL23969626

SCHEMBL23969626

O=C1c2ccccc2C(=O)N1OC(=O)C1(c2ccc(Cl)cc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 14/20 0.45
CYP2D6 P10635 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPT P10636 1/20 0.44
OPRM1 P35372 1/20 0.43
SIGMAR1 Q99720 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL21848402 0.88 HSD11B1 (0.44) HSD11B1MEN1KMT2AOPRM1
SCHEMBL24097137 0.83 AKR1C1 (0.47) HSD11B1CYP2D6MEN1KMT2AOPRM1
SCHEMBL28653670 0.83 AKR1C1 (0.51) CYP2D6MEN1KMT2ASIGMAR1
SCHEMBL30731583 0.82 AKR1C1 (0.50) HSD11B1CYP2D6MEN1KMT2ASIGMAR1
SCHEMBL23969611 0.82 AKR1C1 (0.50) HSD11B1CYP2D6MEN1KMT2ASIGMAR1
SCHEMBL31572848 0.74 ALDH1A1 (0.41) MEN1KMT2AMAPT
SCHEMBL30809222 0.73 ALDH1A1 (0.41) MEN1KMT2AMAPT
SCHEMBL11073957 0.73 KMT2A (0.51) MEN1KMT2AMAPT
SCHEMBL7380213 0.72 HSD11B1 (0.45) HSD11B1MEN1KMT2AOPRM1
SCHEMBL426217 0.71 ALDH1A1 (0.50) MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220024949-A1 CU-AND NI-CATALYZED DECARBOXYLATIVE BORYLATION REACTIONS THE SCRIPPS RESEARCH INSTITUTE 2022-01-27 US disclosed
US-11161859-B2 Cu- and Ni-catalyzed decarboxylative borylation reactions THE SCRIPPS RESEARCH INSTITUTE (US) 2021-11-02 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 (2 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-11161859-B2 Cu- and Ni-catalyzed decarboxylative borylation reactions PCSK9, LIPA, ACSL3 HSD11B1 644/4885CYP2D6 1922/4885MEN1 2765/4885
US-20220024949-A1 CU-AND NI-CATALYZED DECARBOXYLATIVE BORYLATION REACTIONS PCSK9, PCSK7, PCSK6 HSD11B1 589/4885CYP2D6 1786/4885MEN1 2960/4885

“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.