SCHEMBL3790368

SCHEMBL3790368

Nc1cccc(B(O)O)c1O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.43
TSHR P16473 3/20 0.40
CYP3A4 P08684 3/20 0.40
PIK3CA P42336 1/20 0.40
ALOX15 P16050 2/20 0.39
ALDH1A1 P00352 3/20 0.37
ENPP2 Q13822 3/20 0.37
KDM4E B2RXH2 1/20 0.37
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CD44 P16070 1/20 0.36
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PKM P14618 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
SCHEMBL28688124 0.78 CD44 (0.48) TSHRCYP3A4PIK3CAALOX15ALDH1A1
SCHEMBL56105 0.77 CYP3A4 (0.47) TSHRCYP3A4PIK3CAALOX15ALDH1A1
SCHEMBL29780861 0.77 CYP3A4 (0.47) TSHRCYP3A4PIK3CAALOX15ALDH1A1
SCHEMBL3192230 0.76 CYP3A4 (0.59) TSHRCYP3A4PIK3CAALOX15ALDH1A1
SCHEMBL1172644 0.76
Hydrochloric Acid SCHEMBL731024 0.75 CYP3A4 (0.46) TSHRCYP3A4PIK3CAALOX15ALDH1A1
Water SCHEMBL4437578 0.75 CYP3A4 (0.45) TSHRCYP3A4PIK3CAALOX15ALDH1A1
SCHEMBL132727 0.75 ALDH1A1 (0.55) MMP2CYP3A4PIK3CAALOX15ALDH1A1
SCHEMBL29438369 0.75 ALDH1A1 (0.55) MMP2CYP3A4PIK3CAALOX15ALDH1A1
Hydrochloric Acid SCHEMBL29955380 0.75 CYP3A4 (0.46) TSHRCYP3A4PIK3CAALOX15ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8702931-B2 Low cost electrochemical disposable sensor for measuring glycated hemoglobin INDIAN INSTITUTE OF SCIENCE (IN) 2014-04-22 US disclosed
US-20120261257-A1 LOW COST ELECTROCHEMICAL DISPOSABLE SENSOR FOR MEASURING GLYCATED HEMOGLOBIN INDIAN INSTITUTE OF SCIENCE (IN) 2012-10-18 US disclosed
US-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-04-08 US disclosed
EP-1914221-A1 PROCESS FOR PRODUCING BIARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-04-23 EP 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-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND NISCH, BLVRB, BBOX1 MMP2 4559/4885TSHR 1688/4885CYP3A4 177/4885

“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.