SCHEMBL3027426

SCHEMBL3027426

O=[N+]([O-])C=Cc1occc1Br

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
VCP P55072 3/20 0.44
FBP1 P09467 14/20 0.41
EGFR P00533 2/20 0.39
HSP90AA1 P07900 1/20 0.38
ABL1 P00519 1/20 0.36
ABL2 P42684 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPC1 O15118 1/20 0.36
MTOR P42345 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL9684109 0.88 VCP (0.36) VCPFBP1EGFRHSP90AA1ALDH1A1
SCHEMBL10618995 0.79 FBP1 (0.48) VCPFBP1EGFRHSP90AA1ABL1
SCHEMBL12611386 0.74 RXRA (0.42) VCPFBP1EGFRHSP90AA1ABL1
SCHEMBL843402 0.69
SCHEMBL10621127 0.68 FBP1 (0.48) FBP1EGFRHSP90AA1ALDH1A1LMNA
SCHEMBL6168612 0.66
SCHEMBL21654031 0.65
SCHEMBL1027246 0.65 POLB (0.49) FBP1HSP90AA1ALDH1A1MAPT
SCHEMBL2297146 0.65 RXRA (0.58) VCPFBP1EGFRHSP90AA1ALDH1A1
SCHEMBL1027247 0.65 POLB (0.49) FBP1HSP90AA1ALDH1A1MAPT

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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6096225-A OIL IN WATER EMULSION WITH MICROBIOCIDE OIL PHASE NALCO CHEMICAL COMPANY (US) 2000-08-01 US claimed
EP-0603303-A4 ANTIMICROBIAL COMPOSITIONS CONTAINING PROPYLENE CARBONATE AND/OR ETHYLENE CARBONATE AS THE CARRIER SOLVENT. GREAT LAKES CHEMICAL CORP (US) 1994-07-27 EP claimed
EP-0603303-A1 ANTIMICROBIAL COMPOSITIONS CONTAINING PROPYLENE CARBONATE AND/OR ETHYLENE CARBONATE AS THE CARRIER SOLVENT GREAT LAKES CHEMICAL CORPORATION (US) 1994-06-29 EP claimed
WO-1993005032-A1 ANTIMICROBIAL COMPOSITIONS CONTAINING PROPYLENE CARBONATE AND/OR ETHYLENE CARBONATE AS THE CARRIER SOLVENT GREAT LAKES CHEMICAL CORPORATION (US) 1993-03-18 WO claimed
US-5122301-A Stability, nontoxic, nonflammable GREAT LAKES CHEMICAL CORP. (US) 1992-06-16 US claimed
US-20260103840-A1 BIOCIDAL COMPOSITIONS ITALMATCH CHEMICALS GB LTD (GB) 2026-04-16 US disclosed
CN-107613767-B Synergistic preservative composition ISP投资有限公司 2022-06-21 CN disclosed
EP-3288380-B1 SYNERGISTIC PRESERVATIVE COMPOSITIONS ISP INVESTMENTS LLC (US) 2021-11-24 EP disclosed
US-20200040526-A1 BIOCIDAL COMPOSITIONS ITALMATCH CHEMICALS GB LIMITED (GB) 2020-02-06 US disclosed
US-10480125-B2 Biocidal compositions BWA WATER ADDITIVES UK LIMITED (GB) 2019-11-19 US disclosed
US-20180092357-A1 SYNERGISTIC PRESERVATIVE COMPOSITIONS ISP INVESTMENTS LLC (US) 2018-04-05 US disclosed
EP-3288380-A1 SYNERGISTIC PRESERVATIVE COMPOSITIONS ISP Investments LLC (US) 2018-03-07 EP disclosed
EP-0561994-A1 PROCESS FOR THE PREPARATION OF 2-(2-BROMO-2-NITROETHENYL)FURAN. GREAT LAKES CHEMICAL CORP (US) 1993-09-29 EP disclosed
WO-1993005032-A1 ANTIMICROBIAL COMPOSITIONS CONTAINING PROPYLENE CARBONATE AND/OR ETHYLENE CARBONATE AS THE CARRIER SOLVENT GREAT LAKES CHEMICAL CORPORATION (US) 1993-03-18 WO disclosed
WO-1993005032-A1 ANTIMICROBIAL COMPOSITIONS CONTAINING PROPYLENE CARBONATE AND/OR ETHYLENE CARBONATE AS THE CARRIER SOLVENT GREAT LAKES CHEMICAL CORPORATION (US) 1993-03-18 WO disclosed
US-5138076-A Reacting furfural with primary amine in a solvent to form schiffs base, removal of sovent and water formed, dissolving intermediate in polar solvent, reacting with bromonitromethane GREAT LAKES CHEMICAL CORPORATION (US) 1992-08-11 US disclosed
US-5138076-A Reacting furfural with primary amine in a solvent to form schiffs base, removal of sovent and water formed, dissolving intermediate in polar solvent, reacting with bromonitromethane GREAT LAKES CHEMICAL CORPORATION (US) 1992-08-11 US disclosed
US-5122301-A Stability, nontoxic, nonflammable GREAT LAKES CHEMICAL CORP. (US) 1992-06-16 US disclosed
WO-1992009591-A1 PROCESS FOR THE PREPARATION OF 2-(2-BROMO-2-NITROETHENYL)FURAN GREAT LAKES CHEMICAL CORPORATION (US) 1992-06-11 WO disclosed
WO-1992009591-A1 PROCESS FOR THE PREPARATION OF 2-(2-BROMO-2-NITROETHENYL)FURAN GREAT LAKES CHEMICAL CORPORATION (US) 1992-06-11 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 (4 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-20260103840-A1 BIOCIDAL COMPOSITIONS PHOSPHO1, CLIC1, BCHE VCP 4754/4885FBP1 1683/4885EGFR 2103/4885
US-10480125-B2 Biocidal compositions C9, PHOSPHO1, BRI3BP VCP 4718/4885FBP1 2699/4885EGFR 1808/4885
US-20200040526-A1 BIOCIDAL COMPOSITIONS C9, PHOSPHO1, BRI3BP VCP 4718/4885FBP1 2699/4885EGFR 1808/4885
US-20180092357-A1 SYNERGISTIC PRESERVATIVE COMPOSITIONS PIEZO1, CASP1, PRNP VCP 1701/4885FBP1 2253/4885EGFR 4713/4885

“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.