SCHEMBL16557296

SCHEMBL16557296

O=CN[C@@H](CCCCNC(=O)OCc1ccccc1)C(=O)ON1C(=O)CCC1=O

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP8 Q6V1X1 3/20 0.52
DPP7 Q9UHL4 3/20 0.52
FOLH1 Q04609 3/20 0.51
DPP4 P27487 2/20 0.48
DPP9 Q86TI2 2/20 0.48
MMP2 P08253 1/20 0.48
MMP9 P14780 1/20 0.48
TGM2 P21980 2/20 0.47
ACE P12821 2/20 0.47
HTT P42858 1/20 0.46
ANPEP P15144 1/20 0.46

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
SCHEMBL9976419 0.89 FOLH1 (0.56) DPP8DPP7FOLH1MMP2MMP9
SCHEMBL18337922 0.89 FOLH1 (0.56) DPP8DPP7FOLH1MMP2MMP9
SCHEMBL8613001 0.86 FOLH1 (0.52) DPP8DPP7FOLH1TGM2HTT
SCHEMBL12727090 0.84 FOLH1 (0.54) DPP8DPP7FOLH1DPP4DPP9
SCHEMBL16557260 0.83 FOLH1 (0.67) DPP8DPP7FOLH1MMP2MMP9
SCHEMBL356734 0.83 KLK7 (0.63) FOLH1
SCHEMBL2803734 0.83 KLK7 (0.63) FOLH1
SCHEMBL8209334 0.82 HTT (0.53) DPP8DPP7FOLH1DPP4DPP9
SCHEMBL11294170 0.81 HTT (0.52) DPP8DPP7FOLH1DPP4DPP9
SCHEMBL11048769 0.81 HTT (0.52) DPP8DPP7FOLH1DPP4DPP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160213742-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF FUNGAL INFECTIONS CIDARA THERAPEUTICS, INC. (US) 2016-07-28 US disclosed
US-20160213742-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF FUNGAL INFECTIONS CIDARA THERAPEUTICS, INC. (US) 2016-07-28 US disclosed
WO-2015035102-A2 COMPOSITIONS AND METHODS FOR THE TREATMENT OF FUNGAL INFECTIONS CIDARA THERAPEUTICS, INC. (US) 2015-03-12 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-20160213742-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF FUNGAL INFECTIONS FPR1, FPR3, FPR2 DPP8 1179/4885DPP7 1039/4885FOLH1 217/4885

“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.