SCHEMBL16228013

SCHEMBL16228013

CNC(=O)C(Cc1ccccc1)NC(=O)C(CCCCNC(=O)C(F)(F)F)NC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 14/20 0.52
▸ MMP3 P08254 13/20 0.52
▸ MMP8 P22894 4/20 0.52
▸ MMP2 P08253 14/20 0.49
▸ MMP7 P09237 4/20 0.47
▸ MMP9 P14780 1/20 0.47

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
SCHEMBL16228011 1.00 MMP1 (0.52) MMP1MMP3MMP8MMP2MMP7
SCHEMBL14932681 0.88 MMP1 (0.54) MMP1MMP3MMP8MMP2MMP9
SCHEMBL14932673 0.88 MMP3 (0.52) MMP1MMP3MMP8MMP2MMP7
Hydrochloric Acid SCHEMBL16228017 0.87 MMP3 (0.51) MMP1MMP3MMP8MMP2MMP7
Hydrochloric Acid SCHEMBL16228016 0.87 MMP3 (0.51) MMP1MMP3MMP8MMP2MMP7
SCHEMBL16288647 0.82 NPY1R (0.49) —
SCHEMBL11888385 0.82 NPC1 (0.46) —
SCHEMBL16227576 0.82 NPY4R (0.54) MMP1MMP3MMP8MMP2
SCHEMBL8169814 0.79 MMP1 (0.53) MMP1MMP3MMP8MMP2MMP7
SCHEMBL8169810 0.79 MMP1 (0.53) MMP1MMP3MMP8MMP2MMP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10626438-B2 Fluorescent substrates for determining lysine modifying enzyme activity THE BROAD INSTITUTE, INC. (US) 2020-04-21 — — US disclosed
US-20180155760-A1 FLUORESCENT SUBSTRATES FOR DETERMINING LYSINE MODIFYING ENZYME ACTIVITY BROAD INST INC (US) 2018-06-07 — — US disclosed
US-9856509-B2 Fluorescent substrates for determining lysine modifying enzyme activity THE BROAD INSTITUTE, INC. (US) 2018-01-02 — — US disclosed
US-20140335550-A1 FLUORESCENT SUBSTRATES FOR DETERMINING LYSINE MODIFYING ENZYME ACTIVITY THE BROAD INSTITUTE, INC. (US) 2014-11-13 — — 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-20180155760-A1 FLUORESCENT SUBSTRATES FOR DETERMINING LYSINE MODIFYING ENZYME ACTIVITY KDM1A, MAN2B1, KDM3A MMP1 476/4885MMP3 328/4885MMP8 2643/4885
US-10626438-B2 Fluorescent substrates for determining lysine modifying enzyme activity KDM1A, MAN2B1, KDM3A MMP1 476/4885MMP3 328/4885MMP8 2643/4885
US-20140335550-A1 FLUORESCENT SUBSTRATES FOR DETERMINING LYSINE MODIFYING ENZYME ACTIVITY MAN2B1, KDM1A, KDM3A MMP1 481/4885MMP3 328/4885MMP8 2614/4885

“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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