SCHEMBL14598302

SCHEMBL14598302

NCCCC[C@H](NC(=O)[C@H](Cc1ccc(-c2ccccc2)cc1)NC(=O)CCCC(=O)O)C(N)=O

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 3/20 0.52
▸ ACE P12821 2/20 0.52
▸ CALCRL Q16602 2/20 0.52
▸ SSTR5 P35346 1/20 0.51
▸ ROCK2 O75116 1/20 0.50
▸ MMP2 P08253 1/20 0.49
▸ MMP8 P22894 1/20 0.49
▸ MMP12 P39900 1/20 0.49
▸ MMP13 P45452 1/20 0.49
▸ PTPN1 P18031 1/20 0.49
▸ HPGDS O60760 1/20 0.48
▸ CTSL P07711 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
SCHEMBL14598297 1.00 MME (0.52) MMEACECALCRLSSTR5ROCK2
SCHEMBL14122758 0.86 MMP12 (0.64) MMECALCRLSSTR5ROCK2MMP2
SCHEMBL14122875 0.86 MMP12 (0.64) MMECALCRLSSTR5ROCK2MMP2
SCHEMBL6868685 0.86 MMP12 (0.64) MMECALCRLSSTR5ROCK2MMP2
SCHEMBL14122164 0.86 MMP12 (0.64) MMECALCRLSSTR5ROCK2MMP2
SCHEMBL19112073 0.86 MMP12 (0.64) MMECALCRLSSTR5ROCK2MMP2
SCHEMBL6868588 0.86 MMP12 (0.64) MMECALCRLSSTR5ROCK2MMP2
SCHEMBL6869090 0.86 MMP12 (0.64) MMECALCRLSSTR5ROCK2MMP2
SCHEMBL14598306 0.86 NPY4R (0.62) —
SCHEMBL14598296 0.86 NPY4R (0.62) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070004644-A1 Mediators of reverse cholesterol transport for the treatment of hypercholesterolemia SIRCAR JAGADISH C 2007-01-04 — — US disclosed
US-20070004644-A1 Mediators of reverse cholesterol transport for the treatment of hypercholesterolemia SIRCAR JAGADISH C 2007-01-04 — — 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-20070004644-A1 Mediators of reverse cholesterol transport for the treatment of hypercholesterolemia CETP, LDLR, NPC1L1 MME 2615/4885ACE 2658/4885CALCRL 1395/4885

“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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