SCHEMBL23318889

SCHEMBL23318889

Clc1cccc(-c2cccc(-c3cccc4c3-c3ccccc3C43C4CC5CC(C4)CC3C5)c2)c1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.39
HSD11B1 P28845 3/20 0.37
CXCR3 P49682 1/20 0.36
PGR P06401 6/20 0.34
TDP2 O95551 2/20 0.34
CTSD P07339 2/20 0.34
BACE1 P56817 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
NPY5R Q15761 1/20 0.32

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
SCHEMBL23318634 0.97 HSD11B1 (0.38) PDK2HSD11B1CXCR3PGRTDP2
SCHEMBL23609590 0.91 TDP2 (0.39) PDK2HSD11B1CXCR3PGRTDP2
SCHEMBL23609589 0.91 PDK2 (0.43) PDK2HSD11B1CXCR3PGRTDP2
SCHEMBL23609927 0.91 HSD11B1 (0.39) PDK2HSD11B1CXCR3PGRTDP2
SCHEMBL23609300 0.90 PDK2 (0.35) PDK2HSD11B1BACE1
SCHEMBL24406024 0.87 CXCR3 (0.36) PDK2HSD11B1CXCR3PGRTDP2
SCHEMBL23609842 0.86 HSD11B1 (0.36) PDK2HSD11B1CXCR3PGRTDP2
SCHEMBL23614377 0.86 PDK2 (0.45) PDK2HSD11B1CXCR3PGRTDP2
SCHEMBL25452143 0.86 PDK2 (0.42) PDK2HSD11B1CXCR3PGRTDP2
SCHEMBL25962015 0.85 SLC6A3 (0.38) PDK2HSD11B1CHRM1

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
EP-3826080-B1 NITROGEN-CONTAINING COMPOUND, ELECTRONIC COMPONENT AND ELECTRONIC DEVICE SHAANXI LIGHTE OPTOELECTRONICS MAT CO LTD (CN) 2022-05-11 EP disclosed
EP-3826080-A1 NITROGEN-CONTAINING COMPOUND, ELECTRONIC COMPONENT AND ELECTRONIC DEVICE Shaanxi Lighte Optoelectronics Material Co., Ltd. (CN) 2021-05-26 EP disclosed
US-20210130313-A1 NITROGEN-CONTAINING COMPOUND, ELECTRONIC COMPONENT AND ELECTRONIC DEVICE SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO. LTD. (CN) 2021-05-06 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-20210130313-A1 NITROGEN-CONTAINING COMPOUND, ELECTRONIC COMPONENT AND ELECTRONIC DEVICE EXOC1, NPM1, EXOC4 PDK2 3410/4885HSD11B1 4282/4885CXCR3 3484/4885

“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.