SCHEMBL3075498

SCHEMBL3075498

O=C(O)C1CCN(C(=O)O)C(c2cc(F)c(F)cc2F)C1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 5/20 0.37
DPP4 P27487 11/20 0.36
DPP9 Q86TI2 10/20 0.36
DPP8 Q6V1X1 9/20 0.36
DPP7 Q9UHL4 9/20 0.36
KDM4E B2RXH2 2/20 0.33
TSHR P16473 1/20 0.33
USP2 O75604 1/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CYP2D6 P10635 1/20 0.32
KCNH2 Q12809 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL581895 0.85 NOTUM (0.33) NOTUMDPP4DPP9DPP8DPP7
SCHEMBL3086468 0.85 NOTUM (0.42) NOTUMDPP4DPP9DPP8DPP7
SCHEMBL582014 0.83 NOTUM (0.43) NOTUMDPP4
SCHEMBL587099 0.81 ALDH1A1 (0.34) DPP4DPP9DPP8DPP7KDM4E
SCHEMBL582163 0.81 NOTUM (0.46) NOTUMTSHRCYP2C19
SCHEMBL582066 0.81 SLC6A9 (0.40) NOTUMDPP4DPP9DPP8DPP7
SCHEMBL3081192 0.80 NOTUM (0.37) NOTUMDPP4DPP9DPP8DPP7
SCHEMBL586675 0.78 FFAR4 (0.50) NOTUMDPP4DPP8DPP7
SCHEMBL581861 0.78 NOTUM (0.38) NOTUM
SCHEMBL586549 0.78 FFAR2 (0.41) NOTUMCYP2D6CYP2C19

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-8415378-B2 Isoxazol-3(2H)-one analogs as therapeutic agents ASTRAZENECA AB (SE) 2013-04-09 US disclosed
US-20100261755-A1 ISOXAZOL-3(2H)-ONE ANALOGS AS THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2010-10-14 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-20100261755-A1 ISOXAZOL-3(2H)-ONE ANALOGS AS THERAPEUTIC AGENTS NR4A3, CBR3, OXER1 NOTUM 2559/4885DPP4 754/4885DPP9 3914/4885

“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.