SCHEMBL3334973

SCHEMBL3334973

C=CCC1(C)C(=O)NC1C(=O)OC

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
HTR1A P08908 1/20 0.30
TP53 P04637 2/20 0.30
TSHR P16473 2/20 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
SCHEMBL3334968 1.00 KMT2A (0.38) KMT2AALDH1A1KDM4EGAAMAPT
SCHEMBL13801439 0.82 HTT (0.33) ALDH1A1
SCHEMBL26100775 0.78 ALDH1A1 (0.37) KMT2AALDH1A1KDM4EGAAMAPT
SCHEMBL7409632 0.72 KMT2A (0.46) KMT2AALDH1A1GAAMAPTNPSR1
SCHEMBL7409634 0.72 KMT2A (0.46) KMT2AALDH1A1GAAMAPTNPSR1
SCHEMBL21360016 0.70 ALDH1A1 (0.33) ALDH1A1KDM4EGAAMAPTNPSR1
SCHEMBL21360164 0.67 GAA (0.36) ALDH1A1KDM4EGAAMAPTNPSR1
SCHEMBL16325499 0.67 HTT (0.34)
SCHEMBL21359888 0.66 ELANE (0.34) ALDH1A1KDM4EGAAMAPTNPSR1
SCHEMBL21183544 0.65 KMT2A (0.42) KMT2AALDH1A1KDM4EGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100144698-A1 SUBSTITUTED AZETIDINONES DAIAMED (US) 2010-06-10 US disclosed
US-20090143351-A1 SUBSTITUTED AZETIDINONES DAIAMED (US) 2009-06-04 US disclosed
US-7501404-B2 Substituted azetidinones DAIMED (US) 2009-03-10 US disclosed
EP-1871741-A2 SUBSTITUTED AZETIDINONES Daiamed, Inc. (US) 2008-01-02 EP disclosed
US-20070105832-A1 Substituted azetidinones Cadrenal Therapeutics, Inc. 2007-05-10 US disclosed
WO-2006108039-A2 SUBSTITUTED AZETIDINONES DAIAMED, INC. (US) 2006-10-12 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 (3 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-20070105832-A1 Substituted azetidinones F2R, CPA3, CFD KMT2A 1432/4885ALDH1A1 2503/4885KDM4E 1463/4885
US-20100144698-A1 SUBSTITUTED AZETIDINONES F2R, CPA3, CFD KMT2A 1432/4885ALDH1A1 2503/4885KDM4E 1463/4885
US-20090143351-A1 SUBSTITUTED AZETIDINONES F2R, CPA3, CFD KMT2A 1432/4885ALDH1A1 2503/4885KDM4E 1463/4885

“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.