SCHEMBL4882894

SCHEMBL4882894

Clc1cc(Cl)c(Cl)c(B(c2cc(Cl)cc(Cl)c2Cl)c2cc(Cl)cc(Cl)c2Cl)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.58
AHR P35869 7/20 0.46
TSHR P16473 5/20 0.46
HSD17B10 Q99714 5/20 0.46
HPGD P15428 4/20 0.46
CYP3A4 P08684 4/20 0.39
RECQL P46063 2/20 0.39
TP53 P04637 2/20 0.34
CASP1 P29466 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
ALOX12 P18054 1/20 0.34
MAPK1 P28482 1/20 0.34
CASP7 P55210 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CRHBP P24387 1/20 0.33
CRHR2 Q13324 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
SCHEMBL1513485 0.79 ALDH1A1 (0.52) ALDH1A1AHRTSHRHSD17B10HPGD
SCHEMBL29955761 0.79 ALDH1A1 (0.52) ALDH1A1AHRTSHRHSD17B10HPGD
SCHEMBL358001 0.75 ALDH1A1 (1.00) ALDH1A1AHRTSHRHSD17B10HPGD
SCHEMBL4889759 0.74 ALDH1A1 (0.39) ALDH1A1AHRTSHRHSD17B10HPGD
SCHEMBL4885876 0.70 ALDH1A1 (0.36) ALDH1A1AHRTSHRHSD17B10HPGD
SCHEMBL560391 0.69 ALDH1A1 (0.86) ALDH1A1AHRTSHRHSD17B10HPGD
SCHEMBL4886573 0.69 KMT2A (0.40) ALDH1A1TSHRHSD17B10HPGDKDM4E
SCHEMBL2930780 0.67 ALDH1A1 (0.69) ALDH1A1AHRTSHRHSD17B10HPGD
SCHEMBL4889444 0.67 ALDH1A1 (0.50) ALDH1A1AHRTSHRHSD17B10HPGD
SCHEMBL4882904 0.67 TP53 (0.52) ALDH1A1AHRTSHRHSD17B10CYP3A4

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 ALDH1A1 1928/4885AHR 2/4885TSHR 3726/4885

“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.