SCHEMBL11937142

SCHEMBL11937142

Cc1ccc(/C=C/C(=O)c2cccc(O)c2)c(Cl)c1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CHRNA7 P36544 2/20 0.63
▸ DPP4 P27487 1/20 0.60
▸ NR1H4 Q96RI1 2/20 0.56
▸ P4HB P07237 3/20 0.55
▸ TYR P14679 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ HSP90AA1 P07900 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ ABCG2 Q9UNQ0 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ PKM P14618 1/20 0.49
▸ BACE1 P56817 1/20 0.49
▸ USP2 O75604 1/20 0.48

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
SCHEMBL11937145 0.86 MAPT (0.64) CHRNA7DPP4MEN1HSP90AA1MAPT
SCHEMBL14290443 0.86 CHRNA7 (0.67) CHRNA7DPP4NR1H4P4HBTYR
SCHEMBL1225517 0.83 ALDH1A1 (0.62) CHRNA7MAPTKMT2AKDM4EALDH1A1
SCHEMBL1225514 0.83 ALDH1A1 (0.62) CHRNA7MAPTKMT2AKDM4EALDH1A1
SCHEMBL11937143 0.81 NR1H4 (0.60) CHRNA7DPP4NR1H4P4HBTYR
SCHEMBL3058720 0.80 CHRNA7 (0.62) CHRNA7DPP4NR1H4P4HBTYR
SCHEMBL3058724 0.80 CHRNA7 (0.62) CHRNA7DPP4NR1H4P4HBTYR
SCHEMBL28068228 0.80 TYR (0.72) CHRNA7DPP4TYRMEN1HSP90AA1
SCHEMBL9342715 0.80 P4HB (0.73) NR1H4P4HBMEN1MAPTKMT2A
SCHEMBL11937147 0.80 P4HB (0.73) NR1H4P4HBMEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120277252-A1 Antibacterial Agents and Methods of Use Thereof WISCONSIN ALUMNI RESEARCH FOUNDATION 2012-11-01 — — US disclosed
US-8227616-B2 Cyanopyridine antibacterial agents and methods of use thereof WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2012-07-24 — — US disclosed
US-20100261763-A1 ANTIBACTERIAL AGENTS AND METHODS OF USE THEREOF WISCONSIN ALUMNI RESEARCH FOUNDATION 2010-10-14 — — US disclosed
US-7737164-B2 Cyanopyridine antibacterial agents WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2010-06-15 — — US disclosed
US-20080009528-A1 ANTIBACTERIAL AGENTS AND RELATED SCREENING METHODS USING SMALL MOLECULE MACROARRAYS WISCONSIN ALUMNI RESEARCH FOUNDATION 2008-01-10 — — 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 (3 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-20120277252-A1 Antibacterial Agents and Methods of Use Thereof FDPS, ABCG2, DUT CHRNA7 4877/4885DPP4 155/4885NR1H4 2046/4885
US-20080009528-A1 ANTIBACTERIAL AGENTS AND RELATED SCREENING METHODS USING SMALL MOLECULE MACROARRAYS PCNA, ABCG2, API5 CHRNA7 4874/4885DPP4 193/4885NR1H4 2815/4885
US-20100261763-A1 ANTIBACTERIAL AGENTS AND METHODS OF USE THEREOF FDPS, CYP3A5, ABCG2 CHRNA7 4877/4885DPP4 150/4885NR1H4 2047/4885

“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.

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