SCHEMBL17986401

SCHEMBL17986401

NC(=O)[C@@H](CCC(=O)O)NC(=O)CCN1C(=O)C=CC1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 4/20 0.46
MMP2 P08253 3/20 0.46
MMP8 P22894 3/20 0.46
PTGS1 P23219 4/20 0.45
PTGS2 P35354 4/20 0.45
HPGDS O60760 1/20 0.43
MMP13 P45452 2/20 0.43
MMP3 P08254 1/20 0.39
MMP10 P09238 1/20 0.39
MMP9 P14780 1/20 0.39
FNTA P49354 3/20 0.39
FNTB P49356 3/20 0.39
PTPN1 P18031 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA9 Q16790 1/20 0.37
NOD1 Q9Y239 1/20 0.36
NPFFR1 Q9GZQ6 1/20 0.36
FOLH1 Q04609 1/20 0.36
RIMKLA Q8IXN7 1/20 0.36

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
SCHEMBL16273731 0.89 FOLH1 (0.49) PTGS1PTGS2FNTAFNTBFOLH1
SCHEMBL15919123 0.89 FOLH1 (0.49) PTGS1PTGS2FNTAFNTBFOLH1
SCHEMBL24141118 0.87 HPGDS (0.47) MMP12MMP2MMP8PTGS1PTGS2
SCHEMBL9363327 0.84 HPGDS (0.43) PTGS1PTGS2HPGDSFNTAFNTB
SCHEMBL17775702 0.84 PTGS1 (0.54) MMP12MMP2MMP8PTGS1PTGS2
SCHEMBL11932161 0.82 PTGS1 (0.38) MMP12MMP2MMP8PTGS1PTGS2
SCHEMBL19429720 0.82 ALB (0.47) PTGS1PTGS2NOD1NPFFR1
SCHEMBL16156903 0.81 PTGS1 (0.53) PTGS1PTGS2NOD1FOLH1RIMKLA
SCHEMBL31047765 0.80 PTGS1 (0.49) PTGS1PTGS2NOD1
SCHEMBL23953334 0.80 PTGS1 (0.43) MMP12MMP2MMP8PTGS1PTGS2

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-20160220707-A1 SELECTIVE DELIVERY MOLECULES AND METHODS OF USE AVELAS ACQUISITION CORPORATION 2016-08-04 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-20160220707-A1 SELECTIVE DELIVERY MOLECULES AND METHODS OF USE SLC7A1, SLC47A1, SLC47A2 MMP12 203/4885MMP2 275/4885MMP8 549/4885

“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.