SCHEMBL11937145

SCHEMBL11937145

Cc1ccc(/C=C/C(=O)c2ccc(O)cc2)c(Cl)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.64
▸ MEN1 O00255 1/20 0.64
▸ HSP90AA1 P07900 1/20 0.64
▸ KMT2A Q03164 1/20 0.64
▸ MAOB P27338 3/20 0.59
▸ MAOA P21397 2/20 0.59
▸ RAB9A P51151 2/20 0.59
▸ CHRNA7 P36544 1/20 0.59
▸ POLB P06746 1/20 0.59
▸ DPP4 P27487 2/20 0.58
▸ CTSL P07711 2/20 0.56
▸ CTSB P07858 2/20 0.56
▸ TDP1 Q9NUW8 1/20 0.56
▸ CAPN1 P07384 2/20 0.52
▸ CYP1A1 P04798 1/20 0.52
▸ CYP1B1 Q16678 1/20 0.52
▸ CXCL12 P48061 1/20 0.51
▸ BACE1 P56817 1/20 0.51
▸ F3 P13726 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.50

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
SCHEMBL11937142 0.86 CHRNA7 (0.63) MAPTMEN1HSP90AA1KMT2ACHRNA7
SCHEMBL3064890 0.85 MAPT (0.68) MAPTMEN1HSP90AA1KMT2AMAOB
SCHEMBL3064887 0.85 MAPT (0.68) MAPTMEN1HSP90AA1KMT2AMAOB
SCHEMBL29406300 0.85 MAPT (0.68) MAPTMEN1HSP90AA1KMT2AMAOB
SCHEMBL979673 0.84 MAOB (0.63) MAPTMEN1KMT2AMAOBMAOA
SCHEMBL979672 0.84 MAOB (0.63) MAPTMEN1KMT2AMAOBMAOA
SCHEMBL11703114 0.79 ALDH1A1 (0.58) MAPTMEN1KMT2ARAB9APOLB
SCHEMBL28068228 0.79 TYR (0.72) MAPTMEN1HSP90AA1KMT2AMAOB
SCHEMBL17370987 0.78 CHRNA7 (0.71) MAPTMEN1HSP90AA1KMT2AMAOB
SCHEMBL28706431 0.78 MAPT (1.00) MAPTMEN1HSP90AA1KMT2AMAOB

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 MAPT 4708/4885MEN1 3582/4885HSP90AA1 1184/4885
US-20080009528-A1 ANTIBACTERIAL AGENTS AND RELATED SCREENING METHODS USING SMALL MOLECULE MACROARRAYS PCNA, ABCG2, API5 MAPT 4803/4885MEN1 3709/4885HSP90AA1 720/4885
US-20100261763-A1 ANTIBACTERIAL AGENTS AND METHODS OF USE THEREOF FDPS, CYP3A5, ABCG2 MAPT 4715/4885MEN1 3578/4885HSP90AA1 1401/4885

“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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