SCHEMBL23372004

SCHEMBL23372004

Brc1ccccc1Oc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1ccccc1-2

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 15/20 0.41
MEN1 O00255 3/20 0.36
MAPT P10636 3/20 0.36
KMT2A Q03164 3/20 0.36
NPSR1 Q6W5P4 2/20 0.36
KDM4E B2RXH2 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
LMNA P02545 2/20 0.34
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GAA P10253 1/20 0.33
RCE1 Q9Y256 1/20 0.33

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
Phosphine SCHEMBL23633149 0.81 PDK2 (0.53) PDK2MEN1MAPTKMT2AKDM4E
SCHEMBL24604333 0.77 KMT2A (0.38) PDK2MEN1MAPTKMT2ANPSR1
SCHEMBL26580911 0.74 PDK2 (0.54) PDK2MEN1MAPTKMT2ANPSR1
SCHEMBL24531304 0.74 PDK2 (0.48) PDK2MEN1KMT2AKDM4ELMNA
SCHEMBL74839 0.73 ALDH1A1 (0.52) KMT2ALMNAALDH1A1POLBTSHR
SCHEMBL30672129 0.72 PDK2 (0.42) PDK2
SCHEMBL29137464 0.72 PDK2 (0.42) PDK2
SCHEMBL30076231 0.72 ALDH1A1 (0.43) MEN1MAPTKMT2ANPSR1KDM4E
SCHEMBL28854435 0.72 PDK2 (0.52) PDK2MEN1KMT2AKDM4ELMNA
SCHEMBL29897944 0.72 PDK2 (0.52) PDK2MEN1KMT2AKDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210147442-A1 ORGANIC COMPOUND, ELECTROLUMINESCENT MATERIAL, AND APPLICATION THEREOF WUHAN TIANMA MICRO-ELECTRONICS CO., LTD. (CN) 2021-05-20 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-20210147442-A1 ORGANIC COMPOUND, ELECTROLUMINESCENT MATERIAL, AND APPLICATION THEREOF ILK, OSTC, LEF1 PDK2 1076/4885MEN1 2310/4885MAPT 506/4885

“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.