SCHEMBL4461003

SCHEMBL4461003

O=C(O)[C@H]1C=CCN1C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACE P12821 6/20 0.59
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
EGLN1 Q9GZT9 1/20 0.31
ITGB2 P05107 1/20 0.31
ICAM1 P05362 1/20 0.31
ITGAL P20701 1/20 0.31
PIN1 Q13526 1/20 0.30

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
SCHEMBL4454388 1.00 ACE (0.59) ACEPOLBAPEX1TDP1EGLN1
SCHEMBL2229670 1.00 ACE (0.59) ACEPOLBAPEX1TDP1EGLN1
SCHEMBL247111 0.84 ACE (0.58) ACEPOLBAPEX1TDP1EGLN1
SCHEMBL28727117 0.84 ACE (0.58) ACEPOLBAPEX1TDP1EGLN1
SCHEMBL1075993 0.83 ACE (0.43) ACEPIN1
SCHEMBL28290379 0.78 ACE (0.43) ACEPOLBAPEX1TDP1
SCHEMBL6792635 0.78 ACE (0.75) ACE
SCHEMBL6792627 0.78 ACE (0.75) ACE
SCHEMBL4885276 0.78 ACE (0.51) ACEITGB2ICAM1ITGAL
SCHEMBL5127864 0.78 ACE (0.51) ACEITGB2ICAM1ITGAL

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-20210171520-A1 EP300/CREBBP INHIBITOR DAIICHI SANKYO COMPANY, LIMITED (JP) 2021-06-10 US disclosed
EP-3643703-A1 EP300/CREBBP INHIBITOR Daiichi Sankyo Co., Ltd. (JP) 2020-04-29 EP disclosed
US-20090042854-A1 Hexahydro-3H-Pyrrolizin-3-Ones Useful as Tachykinin Receptor Antagonists MERCK SHARP & DOHME CORP. 2009-02-12 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 (2 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-20090042854-A1 Hexahydro-3H-Pyrrolizin-3-Ones Useful as Tachykinin Receptor Antagonists TACR1, PROKR1, TACR2 ACE 196/4885POLB 3324/4885APEX1 3021/4885
US-20210171520-A1 EP300/CREBBP INHIBITOR EP300, CREBBP, CREB1 ACE 1439/4885POLB 1653/4885APEX1 2684/4885

“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.