SCHEMBL1685201

SCHEMBL1685201

CCC1(CC)N(Cl)C(=O)N(Cl)C1(CC)CC

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.35
ELANE P08246 1/20 0.35
CTSG P08311 1/20 0.35
CTRC Q99895 1/20 0.35
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL10353165 0.67
SCHEMBL1685183 0.67 ALDH1A1 (0.35)
SCHEMBL11684434 0.67 ELANE (0.33) ELANENPSR1
SCHEMBL11863981 0.65 ELANE (0.30) ELANE
SCHEMBL630913 0.64 NPSR1 (0.31) NPSR1
SCHEMBL5586971 0.64 ELANE (0.44) F2ELANECTSGCTRCNPSR1
SCHEMBL5346364 0.64 NPSR1 (0.31) NPSR1
SCHEMBL11784414 0.63 NPSR1 (0.46) F2ELANECTSGCTRCNPSR1
SCHEMBL11857814 0.63
SCHEMBL910013 0.62 NPSR1 (0.30) NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7923036-B2 Halogen-containing sanitizing composition PPG INDUSTRIES OHIO, INC. (US) 2011-04-12 US disclosed
US-20100080857-A1 HALOGEN-CONTAINING SANITIZING COMPOSITION PPG INDUSTRIES OHIO, INC. (US) 2010-04-01 US disclosed
EP-0422126-A4 SOLID HALOGEN-CONTAINING COMPOSITION AND METHOD FOR PRODUCING SAME 1992-07-01 EP disclosed
US-5106559-A Contained colored metal comopound PPG INDUSTRIES, INC. (US) 1992-04-21 US disclosed
US-5049385-A Disinfectant PPG INDUSTRIES, INC. (US) 1991-09-17 US disclosed
EP-0422126-A1 SOLID HALOGEN-CONTAINING COMPOSITION AND METHOD FOR PRODUCING SAME PPG INDUSTRIES, INC. (US) 1991-04-17 EP disclosed
EP-0239896-B1 N,N'-DIHALO-2-IMIDAZOLIDINONES PPG INDUSTRIES, INC. (US) 1990-09-05 EP disclosed
WO-1990000006-A1 SOLID HALOGEN-CONTAINING COMPOSITION AND METHOD FOR PRODUCING SAME PPG INDUSTRIES, INC. (US) 1990-01-11 WO disclosed
US-4874532-A Method for decontamination of toxic chemical agents PPG INDUSTRIES, INC. (US) 1989-10-17 US disclosed
US-4767542-A CHLORO-AND BROMO DERIVATIVES PPG INDUSTRIES, INC. (US) 1988-08-30 US disclosed
EP-0239896-A1 N,N'-Dihalo-2-imidazolidinones PPG INDUSTRIES, INC. (US) 1987-10-07 EP disclosed
US-4681948-A BACTERICIDE PPG INDUSTRIES, INC. (US) 1987-07-21 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-20100080857-A1 HALOGEN-CONTAINING SANITIZING COMPOSITION NBAS, BRPF1, PRXL2A F2 3287/4885ELANE 756/4885CTSG 1786/4885

“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.