SCHEMBL4882904

SCHEMBL4882904

Clc1ccc(Cl)c(B(c2cc(Cl)ccc2Cl)c2cc(Cl)ccc2Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.52
TSHR P16473 7/20 0.46
TDP1 Q9NUW8 4/20 0.46
CYP3A4 P08684 4/20 0.46
ALDH1A1 P00352 4/20 0.46
HSD17B10 Q99714 2/20 0.46
MAPK1 P28482 1/20 0.37
LMNA P02545 1/20 0.37
CYP2A6 P11509 1/20 0.37
RAPGEF4 Q8WZA2 1/20 0.36
ALOX15 P16050 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
AHR P35869 1/20 0.36
IDO1 P14902 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL29376152 0.79 TSHR (0.48) TP53TSHRTDP1CYP3A4ALDH1A1
SCHEMBL491658 0.79 TSHR (0.48) TP53TSHRTDP1CYP3A4ALDH1A1
SCHEMBL20260209 0.72 TSHR (0.41) TP53TSHRTDP1CYP3A4ALDH1A1
SCHEMBL22730 0.69
SCHEMBL29349499 0.69
SCHEMBL8873179 0.69 TP53 (1.00) TP53TSHRTDP1CYP3A4ALDH1A1
SCHEMBL5318805 0.67 TP53 (0.93) TP53TSHRTDP1CYP3A4ALDH1A1
SCHEMBL11661765 0.67 TP53 (0.93) TP53TSHRTDP1CYP3A4ALDH1A1
SCHEMBL440944 0.67 TP53 (0.61) TP53TSHRTDP1CYP3A4ALDH1A1
SCHEMBL30433206 0.67 TP53 (0.93) TP53TSHRTDP1CYP3A4ALDH1A1

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
EP-1817318-B1 STABILIZING METHOD AND STABILIZED COMPOSITION FOR ARYL BORON COMPOUNDS NIPPON CATALYTIC CHEM IND (JP) 2013-08-28 EP disclosed
US-20080154065-A1 Stabilizing Method and Stabilized Composition for Aryl Boron Compounds NIPPON SHOKUBAI CO., LTD. (JP) 2008-06-26 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-20080154065-A1 Stabilizing Method and Stabilized Composition for Aryl Boron Compounds AR, AHR, BCL6 TP53 3038/4885TSHR 3726/4885TDP1 3147/4885

“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.