SCHEMBL20792002

SCHEMBL20792002

BN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
HRH1 P35367 2/20 0.47
CACNA1F O60840 1/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
CYP2C9 P11712 1/20 0.47
HTR2A P28223 1/20 0.47
SCN1A P35498 1/20 0.47
SCN4A P35499 1/20 0.47
BLM P54132 1/20 0.47
PMP22 Q01453 1/20 0.47
CACNA1D Q01668 1/20 0.47
KCNH2 Q12809 1/20 0.47
CACNA1S Q13698 1/20 0.47
CACNA1C Q13936 1/20 0.47
SCN5A Q14524 1/20 0.47
SCN2A Q99250 1/20 0.47
SCN3A Q9NY46 1/20 0.47
HRH3 Q9Y5N1 1/20 0.44

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
SCHEMBL3100182 0.76 TSHR (0.59) POLBTDP1HRH1CACNA1FALDH1A1
SCHEMBL14353612 0.76 POLB (0.54) POLBTDP1HRH1CACNA1FALDH1A1
SCHEMBL7860635 0.76 POLB (0.50) POLBTDP1HRH1CACNA1FALDH1A1
SCHEMBL6271031 0.76 POLB (0.50) POLBTDP1HRH1CACNA1FALDH1A1
SCHEMBL1461591 0.76 TDP1 (0.54) POLBTDP1HRH1CACNA1FALDH1A1
SCHEMBL4727177 0.76 ALDH1A1 (0.62) POLBTDP1HRH1CACNA1FALDH1A1
SCHEMBL9013638 0.74 ALDH1A1 (0.61) POLBTDP1HRH1CACNA1FALDH1A1
SCHEMBL14524241 0.72 POLB (0.67) POLBTDP1HRH1HRH3CNR1
SCHEMBL7862767 0.72 POLB (0.62) POLBTDP1HRH1HRH3CNR1
SCHEMBL11925188 0.72 TDP1 (0.54) POLBTDP1HRH1CACNA1FALDH1A1

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
US-10772330-B2 Controlled release N-halamine polymers for water decontamination and detoxification YISSUM RESEARCH DEVELOPMENT COMPANY (IL) 2020-09-15 US disclosed
US-20190069555-A1 CONTROLLED RELEASE N-HALAMINE POLYMERS FOR WATER DECONTAMINATION AND DETOXIFICATION YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2019-03-07 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 (2 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-10772330-B2 Controlled release N-halamine polymers for water decontamination and detoxification COPE, HDHD5, DAP3 POLB 198/4885TDP1 1470/4885HRH1 1214/4885
US-20190069555-A1 CONTROLLED RELEASE N-HALAMINE POLYMERS FOR WATER DECONTAMINATION AND DETOXIFICATION COPE, HDHD5, DAP3 POLB 198/4885TDP1 1470/4885HRH1 1214/4885

“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.