SCHEMBL5403755

SCHEMBL5403755

CC(C)(C)OC(=O)NCCNC(=O)/C=C/[C@H](Cc1ccccc1)NC(=O)Nc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 2/20 0.46
NPY5R Q15761 6/20 0.44
MAPK1 P28482 1/20 0.43
TACR2 P21452 5/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
CHRM4 P08173 1/20 0.42
IDO1 P14902 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
CTSS P25774 1/20 0.40

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
SCHEMBL5403766 1.00 FPR2 (0.46) FPR2NPY5RMAPK1TACR2CYP2C9
SCHEMBL5403771 1.00 FPR2 (0.46) FPR2NPY5RMAPK1TACR2CYP2C9
SCHEMBL5411545 0.91 CTSS (0.46) FPR2IDO1CTSS
SCHEMBL5411531 0.91 CTSS (0.46) FPR2IDO1CTSS
SCHEMBL5411541 0.91 CTSS (0.46) FPR2IDO1CTSS
SCHEMBL8297745 0.89 FPR2 (0.49) FPR2NPY5RMAPK1TACR2CYP2C9
SCHEMBL5406477 0.87 CTSS (0.45) FPR2MAPK1IDO1CTSS
SCHEMBL5406485 0.87 CTSS (0.45) FPR2MAPK1IDO1CTSS
SCHEMBL5406686 0.87 CTSS (0.45) FPR2MAPK1IDO1CTSS
SCHEMBL5406676 0.87 CTSS (0.45) FPR2MAPK1IDO1CTSS

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-7202269-B2 GlyT2 modulators JANSSEN PHARMACEUTICA N.V. (BE) 2007-04-10 US disclosed
US-20050119245-A1 GlyT2 modulators JANSSEN PHARMACEUTICA, N.V. (BE) 2005-06-02 US disclosed
WO-2005044810-A1 GLYT2 MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2005-05-19 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-20050119245-A1 GlyT2 modulators GLRB, GLRA1, GLRA2 FPR2 3048/4885NPY5R 2160/4885MAPK1 2885/4885

“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.