SCHEMBL13993519

SCHEMBL13993519

CCCCCNC(=O)[C@@H](NC(=O)c1ccc2nc(N)ccc2c1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.48
▸ F10 P00742 1/20 0.48
▸ PRSS1 P07477 1/20 0.48
▸ ALDH1A1 P00352 2/20 0.46
▸ MTTP P55157 6/20 0.46
▸ NAAA Q02083 2/20 0.45
▸ CTSL P07711 1/20 0.44
▸ CTSS P25774 1/20 0.44
▸ PLAU P00749 2/20 0.43

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
SCHEMBL5669914 1.00 KDM4E (0.48) KDM4EF10PRSS1ALDH1A1MTTP
SCHEMBL14132458 0.77 MTTP (0.68) MTTP
SCHEMBL1600315 0.77 MTTP (0.70) MTTP
SCHEMBL14186885 0.77 MTTP (0.70) MTTP
SCHEMBL5669917 0.74 PLAU (0.53) PLAU
SCHEMBL5669922 0.74 HDAC1 (0.49) ALDH1A1NAAAPLAU
SCHEMBL3265641 0.72 MTTP (0.70) MTTP
SCHEMBL5669411 0.72 TLR2 (0.39) PRSS1NAAAPLAU
SCHEMBL20777191 0.70 F10 (0.64) KDM4EF10PRSS1MTTPCTSL
SCHEMBL20777192 0.70 F10 (0.64) KDM4EF10PRSS1MTTPCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7468378-B2 Substituted quinoline compounds PFIZER INC. (US) 2008-12-23 — — US disclosed
US-7468378-B2 Substituted quinoline compounds PFIZER INC. (US) 2008-12-23 — — US disclosed
US-7393958-B2 Triamide-substituted heterobicyclic compounds PFIZER, INC. (US) 2008-07-01 — — US disclosed
US-7393958-B2 Triamide-substituted heterobicyclic compounds PFIZER, INC. (US) 2008-07-01 — — US disclosed
US-7368573-B2 Triamide-substituted heterobicyclic compounds PFIZER INC. (US) 2008-05-06 — — US disclosed
US-7368573-B2 Triamide-substituted heterobicyclic compounds PFIZER INC. (US) 2008-05-06 — — US disclosed
US-20070093525-A1 Triamide-substituted heterobicyclic compounds PFIZER INC 2007-04-26 — — US disclosed
US-20070093525-A1 Triamide-substituted heterobicyclic compounds PFIZER INC 2007-04-26 — — 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-20070093525-A1 Triamide-substituted heterobicyclic compounds APOB, MTPN, CTRB1 KDM4E 4358/4885F10 1404/4885PRSS1 937/4885

“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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