SCHEMBL141332

SCHEMBL141332

CO/C=C/[C@H](CCC(=O)OC(C)(C)C)NC(=O)OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.49
CTSL P07711 8/20 0.46
MAPT P10636 1/20 0.44
MBOAT4 Q96T53 1/20 0.43
CTSB P07858 2/20 0.43
PPARA Q07869 1/20 0.42

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
SCHEMBL141333 1.00 SYK (0.49) SYKCTSLMAPTMBOAT4CTSB
SCHEMBL142265 0.87 SYK (0.53) SYKCTSLMAPTCTSB
SCHEMBL115059 0.85 CTSL (0.52) CTSLCTSB
SCHEMBL5971174 0.82 PPARA (0.55) SYKCTSLCTSBPPARA
SCHEMBL2776833 0.82 PPARA (0.55) SYKCTSLCTSBPPARA
SCHEMBL42877 0.82 PPARA (0.55) SYKCTSLCTSBPPARA
SCHEMBL1555742 0.81 SYK (0.57) SYKCTSLMAPTCTSBPPARA
SCHEMBL1555741 0.81 SYK (0.57) SYKCTSLMAPTCTSBPPARA
SCHEMBL20346744 0.81 KYNU (0.54) SYKCTSLMAPTCTSBPPARA
SCHEMBL21541316 0.81 KYNU (0.54) SYKCTSLMAPTCTSBPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120058989-A1 ANTIBACTERIAL FLUOROQUINOLONE ANALOGS ACHAOGEN, INC. (US) 2012-03-08 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-20120058989-A1 ANTIBACTERIAL FLUOROQUINOLONE ANALOGS RECQL, BLVRB, NQO2 SYK 4291/4885CTSL 1109/4885MAPT 4835/4885

“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.