SCHEMBL14448657

SCHEMBL14448657

C[C@H](NC(=O)c1cc(C(=O)NCc2ccc(F)cc2)ncn1)c1ccc(-c2nnn(C)n2)cc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 7/20 0.49
RORC P51449 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
POLB P06746 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.43
PDPK1 O15530 2/20 0.42
PTGER4 P35408 4/20 0.42
SLC22A8 Q8TCC7 1/20 0.41
PDE2A O00408 1/20 0.41

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
SCHEMBL14448627 0.91 MMP13 (0.49) MMP13SMN1; SMN2POLBALDH1A1LMNA
SCHEMBL14448626 0.89 MMP13 (0.48) MMP13SMN1; SMN2POLBALDH1A1LMNA
SCHEMBL14448629 0.88 MMP13 (0.54) MMP13TSHRPDPK1PTGER4SLC22A8
SCHEMBL14448628 0.87 MMP13 (0.46) MMP13SMN1; SMN2POLBTSHRPDPK1
SCHEMBL14448630 0.85 MMP13 (0.52) MMP13TSHRPDPK1PTGER4SLC22A8
SCHEMBL14448625 0.85 MMP13 (0.46) MMP13TSHRPDPK1PTGER4SLC22A8
SCHEMBL14448658 0.85 MMP13 (0.45) MMP13SMN1; SMN2POLBALDH1A1LMNA
SCHEMBL14448631 0.85 MMP13 (0.51) MMP13SMN1; SMN2TSHRPDPK1SLC22A8
SCHEMBL14448624 0.84 XDH (0.49) MMP13SMN1; SMN2POLBALDH1A1LMNA
SCHEMBL14448481 0.83 MMP13 (0.55) MMP13SMN1; SMN2POLBALDH1A1LMNA

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-20070155739-A1 Substituted bis-amide metalloprotease inhibitors ALANTOS PHARMACEUTICALS, INC. 2007-07-05 US disclosed
US-20070155739-A1 Substituted bis-amide metalloprotease inhibitors ALANTOS PHARMACEUTICALS, INC. 2007-07-05 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-20070155739-A1 Substituted bis-amide metalloprotease inhibitors MMP13, MMP9, ADAMTS13 MMP13 1/4885RORC 2386/4885SMN1; SMN2 1621/4885

“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.