SCHEMBL1710892

SCHEMBL1710892

O=C(O)CC[C@H](NC(=O)/C=C/c1ccccc1F)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTPN2 P17706 3/20 0.53
PTPN1 P18031 3/20 0.53
PTPN6 P29350 3/20 0.53
CDC25B P30305 3/20 0.53
MMP2 P08253 1/20 0.49
FOLH1 Q04609 3/20 0.48
NAALAD2 Q9Y3Q0 4/20 0.48
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.44
RECQL P46063 1/20 0.44
RIMKLA Q8IXN7 1/20 0.43
PIN1 Q13526 2/20 0.42
NOS3 P29474 1/20 0.42
NOS1 P29475 1/20 0.42
NOS2 P35228 1/20 0.42

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
SCHEMBL1710894 1.00 PTPN2 (0.53) PTPN2PTPN1PTPN6CDC25BMMP2
SCHEMBL1711375 0.90 PTPN2 (0.51) PTPN2PTPN1PTPN6CDC25BMMP2
SCHEMBL1711509 0.90 PTPN2 (0.51) PTPN2PTPN1PTPN6CDC25BMMP2
Butane SCHEMBL1711385 0.86 PTPN2 (0.48) PTPN2PTPN1PTPN6CDC25BMMP2
SCHEMBL1710952 0.85 PTPN2 (0.55) PTPN2PTPN1PTPN6CDC25BMAPT
SCHEMBL1710949 0.85 PTPN2 (0.55) PTPN2PTPN1PTPN6CDC25BMAPT
Hydrochloric Acid SCHEMBL27829207 0.85 PTPN2 (0.51) PTPN2PTPN1PTPN6CDC25BMMP2
Hydrochloric Acid SCHEMBL1711409 0.85 PTPN2 (0.51) PTPN2PTPN1PTPN6CDC25BMMP2
Hydrochloric Acid SCHEMBL1711412 0.85 PTPN2 (0.51) PTPN2PTPN1PTPN6CDC25BMMP2
SCHEMBL1711285 0.84 PTPN2 (0.50) PTPN2PTPN1PTPN6CDC25BGAA

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-9150510-B2 Amino acid derivative NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 2015-10-06 US disclosed
EP-2345635-A1 AMINO ACID DERIVATIVE Nippon Zoki Pharmaceutical Co., Ltd. (JP) 2011-07-20 EP disclosed
US-20110172442-A1 AMINO ACID DERIVATIVE NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 2011-07-14 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-20110172442-A1 AMINO ACID DERIVATIVE OPRL1, OPRK1, SLC1A1 PTPN2 3704/4885PTPN1 4062/4885PTPN6 3602/4885

“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.