SCHEMBL4705330

SCHEMBL4705330

O=C(O)N[C@H]1CCN([C@@H](Cc2ccc(F)cc2)C(=O)N2CCOCC2)C1=O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.43
KDM1A O60341 1/20 0.42
F10 P00742 8/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HCRTR2 O43614 1/20 0.40
TSHR P16473 1/20 0.39
F2 P00734 1/20 0.39
KLKB1 P03952 1/20 0.39
ELANE P08246 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
POLB P06746 1/20 0.38

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
SCHEMBL4706167 0.91 KDM1A (0.51) MMP8KDM1AF10MEN1KMT2A
SCHEMBL4706069 0.88 KDM1A (0.42) MMP8KDM1AF10TSHRF2
SCHEMBL4704111 0.83 ALDH1A1 (0.42) MMP8KDM1AF10ALDH1A1
Hydrochloric Acid SCHEMBL4757424 0.82 NPC1 (0.44) MMP8KDM1AMEN1KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL4757426 0.82 NPC1 (0.44) MMP8KDM1AMEN1KMT2ASMN1; SMN2
SCHEMBL4705662 0.81 F10 (0.40) MMP8KDM1AF10F2KLKB1
SCHEMBL4705534 0.81 F10 (0.43) F10SMN1; SMN2ALDH1A1F2KLKB1
SCHEMBL4702122 0.81 F10 (0.41) F10F2KLKB1ELANEPOLB
SCHEMBL4706596 0.79 F10 (0.39) F10F2KLKB1ELANEPOLB
SCHEMBL4706056 0.79 F10 (0.39) F10F2KLKB1ELANEPOLB

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
EP-1567489-B1 PYRROLIDIN-2-ONE DERIVATIVES AS INHIBITORS OF THROMBIN AND FACTOR XA GLAXO GROUP LTD (GB) 2008-07-23 EP disclosed
US-20060166985-A1 Pyrrolydin-2-one derivatives as inhibitors of thrombin and factor xa GLAXO GROUP LIMITED (GB) 2006-07-27 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-20060166985-A1 Pyrrolydin-2-one derivatives as inhibitors of thrombin and factor xa TFPI, TFPI2, SERPINC1 MMP8 141/4885KDM1A 2422/4885F10 8/4885

“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.