SCHEMBL4864227

SCHEMBL4864227

COC(=O)C1(C=O)CCCC1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.47
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
MAPT P10636 1/20 0.36
MEN1 O00255 1/20 0.35
CYP3A4 P08684 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
LMNA P02545 1/20 0.33

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
SCHEMBL4872719 0.98 NPSR1 (0.45) NPSR1CYP4F2CYP4A11MAPTMEN1
SCHEMBL2305290 0.98 NPSR1 (0.45) NPSR1CYP4F2CYP4A11MAPTMEN1
SCHEMBL1971946 0.95 NPSR1 (0.42) NPSR1CYP4F2CYP4A11MAPTMEN1
SCHEMBL2547049 0.91
SCHEMBL4866927 0.83 NPSR1 (0.35) NPSR1CYP4F2CYP4A11MEN1CYP3A4
SCHEMBL2289949 0.82 NPSR1 (0.47) NPSR1CYP4F2CYP4A11MAPTMEN1
SCHEMBL5113321 0.81 CYP3A4 (0.40) NPSR1CYP3A4ALDH1A1LMNA
SCHEMBL31711898 0.81 NPSR1 (0.34) NPSR1LMNA
SCHEMBL2290780 0.80 NPSR1 (0.45) NPSR1CYP4F2CYP4A11MAPTMEN1
SCHEMBL11308445 0.80 NPSR1 (0.45) NPSR1CYP4F2CYP4A11MAPTMEN1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5948935-A Process and intermediates for (s)-α-amino-1-carboxycyclopentaneacetic acid BOEHRINGER INGELHEIM (CANADA) LTD. (CA) 1999-09-07 US claimed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-8816090-B2 Benzisoxazole derivatives PFIZER INC. (US) 2014-08-26 US disclosed
EP-1856114-B1 BENZISOXAZOLE DERIVATIVES PFIZER (US) 2014-08-20 EP disclosed
US-20080207690-A1 Benzisoxazole Derivatives RAQUALIA PHARMA INC. (JP) 2008-08-28 US disclosed
US-7332485-B2 Peptide deformylase inhibitors SMITHKLINE BEECHAM CORP (US) 2008-02-19 US disclosed
EP-1856114-A1 BENZISOXAZOLE DERIVATIVES Pfizer, Inc. (US) 2007-11-21 EP disclosed
WO-2006090224-A1 BENZISOXAZOLE DERIVATIVES PFIZER JAPAN INC. (JP) 2006-08-31 WO disclosed
US-20060160802-A1 Peptide deformylase inhibitors GLAXO GROUP LIMITED 2006-07-20 US disclosed
WO-2005005456-A2 PEPTIDE DEFORMYLASE INHIBITORS GLAXO GROUP LIMITED (GB) 2005-01-20 WO disclosed
US-5948935-A Process and intermediates for (s)-α-amino-1-carboxycyclopentaneacetic acid BOEHRINGER INGELHEIM (CANADA) LTD. (CA) 1999-09-07 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-20060160802-A1 Peptide deformylase inhibitors PDF, PEPD, DPEP1 NPSR1 3037/4885CYP4F2 4042/4885CYP4A11 4676/4885
US-20080207690-A1 Benzisoxazole Derivatives BRS3, MRGPRX4, HTR4 NPSR1 30/4885CYP4F2 681/4885CYP4A11 451/4885

“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.