SCHEMBL3221064

SCHEMBL3221064

NC(CCc1ccccc1)C(=O)NC(CC1CCCCC1)C(=O)NCCc1c[nH]cn1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 17/20 0.56
MMP2 P08253 16/20 0.56
MMP1 P03956 14/20 0.56
MMP9 P14780 1/20 0.50

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
SCHEMBL7622435 0.84 CTSC (0.42)
SCHEMBL3217867 0.84 CTSC (0.42)
SCHEMBL7644948 0.81 MMP3 (0.43) MMP3MMP2MMP1MMP9
SCHEMBL7644955 0.81 MMP3 (0.43) MMP3MMP2MMP1MMP9
SCHEMBL7620530 0.81 METAP2 (0.41) MMP3MMP2MMP1
SCHEMBL3210794 0.81 METAP2 (0.41) MMP3MMP2MMP1
SCHEMBL3221055 0.78 F2RL1 (0.47) MMP3MMP2MMP1
SCHEMBL21794975 0.77 KMT2A (0.50) MMP2
SCHEMBL30799721 0.75 LTA4H (0.47) MMP3MMP2MMP1
SCHEMBL7643594 0.74 KMT2A (0.45)

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-7683097-B2 Topoisomerase inhibitors Propharmacon Inc. (US) 2010-03-23 US claimed
US-7683097-B2 Topoisomerase inhibitors Propharmacon Inc. (US) 2010-03-23 US disclosed
US-20070004701-A1 Topoisomerase inhibitors PROPHARMACON, INC. (US) 2007-01-04 US disclosed
WO-2006022955-A2 TOPOISOMERASE INHIBITORS PROPHARMACON, INC. (US) 2006-03-02 WO 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-20070004701-A1 Topoisomerase inhibitors TOP1, TOP2A, TOP2B MMP3 753/4885MMP2 2089/4885MMP1 2125/4885

“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.