SCHEMBL1703308

SCHEMBL1703308

CCC(O)C(Br)(Br)[N+](=O)[O-]

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
TSHR P16473 2/20 0.39
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL1703572 0.80 TSHR (0.42) LMNATSHRALDH1A1KDM4E
SCHEMBL8736362 0.78 LMNA (0.37) LMNATSHRALDH1A1KDM4E
SCHEMBL13875108 0.77 LMNA (0.45) LMNATSHRALDH1A1
SCHEMBL2637044 0.76 TSHR (0.42) LMNATSHRALDH1A1
SCHEMBL10935741 0.74 TSHR (0.46) LMNATSHRALDH1A1KDM4E
SCHEMBL426138 0.73
SCHEMBL8736355 0.72 LMNA (0.36) LMNA
SCHEMBL19353730 0.71 LMNA (0.38) LMNATSHRALDH1A1
SCHEMBL9069816 0.71 ALDH1A1 (0.44) TSHRALDH1A1KDM4E
SCHEMBL1703301 0.70 LMNA (0.36) LMNAALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2440047-A1 BROMINATED NITROALKANOL COMPOSITIONS AND THEIR USE AS BIOCIDES Dow Global Technologies LLC (US) 2012-04-18 EP claimed
US-20100317744-A1 BROMINATED NITROALKANOL COMPOSITIONS AND THEIR USE AS BIOCIDES DDP SPECIALTY ELECTRONIC MATERIALS US, LLC. 2010-12-16 US claimed
WO-2010144511-A1 BROMINATED NITROALKANOL COMPOSITIONS AND THEIR USE AS BIOCIDES DOW GLOBAL TECHNOLOGIES INC. (US) 2010-12-16 WO claimed
US-8993638-B2 Brominated nitroalkanol compositions and their use as biocides DOW GLOBAL TECHNOLOGIES LLC (US) 2015-03-31 US disclosed
EP-2440047-A1 BROMINATED NITROALKANOL COMPOSITIONS AND THEIR USE AS BIOCIDES Dow Global Technologies LLC (US) 2012-04-18 EP disclosed
US-20100317744-A1 BROMINATED NITROALKANOL COMPOSITIONS AND THEIR USE AS BIOCIDES DDP SPECIALTY ELECTRONIC MATERIALS US, LLC. 2010-12-16 US disclosed
WO-2010144511-A1 BROMINATED NITROALKANOL COMPOSITIONS AND THEIR USE AS BIOCIDES DOW GLOBAL TECHNOLOGIES INC. (US) 2010-12-16 WO 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-20100317744-A1 BROMINATED NITROALKANOL COMPOSITIONS AND THEIR USE AS BIOCIDES BLVRB, BCL2A1, CBR1 LMNA 3901/4885TSHR 3272/4885ALDH1A1 814/4885

“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.