SCHEMBL4846135

SCHEMBL4846135

CC(=C(NC(=O)OCc1ccccc1)C(=O)O)c1cc(Br)ccc1OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 10/20 0.53
LMNA P02545 4/20 0.48
USP2 O75604 1/20 0.48
POLB P06746 2/20 0.47
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
HPGD P15428 1/20 0.46
AAK1 Q2M2I8 2/20 0.46
HTT P42858 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
FOLH1 Q04609 1/20 0.44

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
SCHEMBL4846126 1.00 LRRK2 (0.53) LRRK2LMNAUSP2POLBALDH1A1
SCHEMBL4853971 0.83 LRRK2 (0.48) LRRK2LMNAUSP2POLBALDH1A1
SCHEMBL4853974 0.83 LRRK2 (0.48) LRRK2LMNAUSP2POLBALDH1A1
SCHEMBL6452235 0.79 PTGDR2 (0.67) LRRK2LMNAUSP2POLBALDH1A1
SCHEMBL30591972 0.79 PTGDR2 (0.67) LRRK2LMNAUSP2POLBALDH1A1
SCHEMBL552025 0.78 LRRK2 (0.57) LRRK2LMNAPOLBALDH1A1KDM4E
SCHEMBL384896 0.78 FOLH1 (0.68) LRRK2LMNAPOLBALDH1A1KDM4E
SCHEMBL5431545 0.77 LRRK2 (0.63) LRRK2LMNAUSP2POLBALDH1A1
SCHEMBL29473232 0.75 LRRK2 (0.54) LRRK2LMNAUSP2AAK1HTT
SCHEMBL6492975 0.75 LRRK2 (0.60) LRRK2LMNAUSP2POLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7446102-B2 Antibacterial amide macrocycles IV AICURIS GMBH & CO. KG (DE) 2008-11-04 US disclosed
US-20080076745-A1 ANTIBACTERIAL AMIDE MACROCYCLES IV AICURIS GMBH & CO. KG (DE) 2008-03-27 US disclosed
US-20050256037-A1 Antibacterial amide macrocyles BAYER HEALTHCARE AG (DE) 2005-11-17 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 (2 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-20080076745-A1 ANTIBACTERIAL AMIDE MACROCYCLES IV NOD2, AAAS, AADAC LRRK2 2027/4885LMNA 3175/4885USP2 4102/4885
US-20050256037-A1 Antibacterial amide macrocyles AADAC, PAM, NOD2 LRRK2 3614/4885LMNA 2711/4885USP2 2431/4885

“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.