SCHEMBL12201716

SCHEMBL12201716

CCC(C)CNC(=O)CCN1C(=O)C=CC1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT2A Q92830 1/20 0.39
KAT2B Q92831 1/20 0.39
PTGS1 P23219 7/20 0.38
PTGS2 P35354 7/20 0.38
MGLL Q99685 5/20 0.38
FAAH O00519 3/20 0.38
ALDH1A1 P00352 3/20 0.36
BLM P54132 2/20 0.36
LMNA P02545 2/20 0.36
MAPT P10636 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
GMNN O75496 1/20 0.36
THPO P40225 1/20 0.36
PMP22 Q01453 1/20 0.36
HPGD P15428 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
WRN Q14191 1/20 0.36
HIF1A Q16665 1/20 0.36
OPRM1 P35372 2/20 0.35

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
SCHEMBL18553064 0.85 HSD17B10 (0.39) PTGS1PTGS2MGLLFAAHALDH1A1
SCHEMBL15892774 0.84 HPGD (0.37) KAT2AKAT2BPTGS1PTGS2MGLL
SCHEMBL20470971 0.83 KAT2A (0.39) KAT2AKAT2BPTGS1PTGS2MGLL
SCHEMBL26554900 0.82 KAT2A (0.35) KAT2AKAT2BPTGS1PTGS2MGLL
SCHEMBL2226946 0.81 PTGS1 (0.42) KAT2AKAT2BPTGS1PTGS2MGLL
SCHEMBL2754833 0.80 PTGS1 (0.44) PTGS1PTGS2MGLLFAAHALDH1A1
SCHEMBL12107529 0.79 ALDH1A1 (0.39) PTGS1PTGS2MGLLFAAHALDH1A1
SCHEMBL15489016 0.79 MGLL (0.34) MGLLHPGDCYP2C19OPRM1OPRD1
SCHEMBL23395065 0.78 PTGS1 (0.38) PTGS1PTGS2MGLLFAAHALDH1A1
SCHEMBL14655039 0.78 PTGS1 (0.40) KAT2AKAT2BPTGS1PTGS2MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8034981-B2 Modified bio-related substance, process for producing the same, and intermediate NOF CORPORATION (JP) 2011-10-11 US disclosed
US-20110082277-A1 MODIFIED BIO-RELATED SUBSTANCE, PROCESS FOR PRODUCING THE SAME, AND INTERMEDIATE NOF CORPORATION (JP) 2011-04-07 US disclosed
US-7851491-B2 Modified bio-related substance, process for producing the same, and intermediate NOF CORPORATION (JP) 2010-12-14 US disclosed
US-20090280106-A1 Pituitary adenylate cyclase acivating peptide (pacap) receptor (vpac2) agonists and their pharmacological methods of use BAYER PHARMACEUTICALS CORPORATION (US) 2009-11-12 US disclosed
US-20090192320-A1 MODIFIED BIO-RELATED SUBSTANCE, PROCESS FOR PRODUCING THE SAME, AND INTERMEDIATE NOF CORPORATION (JP) 2009-07-30 US disclosed
US-20090171071-A1 PYY Agonists and Uses Thereof PFIZER INC. 2009-07-02 US disclosed
US-20090170778-A1 PYY Agonists and Uses Thereof PFIZER INC. 2009-07-02 US disclosed
US-7524875-B2 Modified bio-related substance, process for producing the same, and intermediate NOF CORPORATION (JP) 2009-04-28 US disclosed
US-20090005297-A1 Aprotinin Variants BAYER HEALTHCARE AG (DE) 2009-01-01 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 (5 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-20090192320-A1 MODIFIED BIO-RELATED SUBSTANCE, PROCESS FOR PRODUCING THE SAME, AND INTERMEDIATE BMP1, BMP2, AQP1 KAT2A 2322/4885KAT2B 2886/4885PTGS1 41/4885
US-20090280106-A1 Pituitary adenylate cyclase acivating peptide (pacap) receptor (vpac2) agonists and their pharmacological methods of use ADCYAP1R1, VIPR2, ADCY2 KAT2A 1405/4885KAT2B 2453/4885PTGS1 2785/4885
US-20090171071-A1 PYY Agonists and Uses Thereof NPY1R, NPY2R, NPY4R KAT2A 4198/4885KAT2B 4561/4885PTGS1 1536/4885
US-20090170778-A1 PYY Agonists and Uses Thereof NPY1R, NPY2R, NPY4R KAT2A 4198/4885KAT2B 4561/4885PTGS1 1536/4885
US-20090005297-A1 Aprotinin Variants PRSS1, SPINT2, SERPINB1 KAT2A 4401/4885KAT2B 4329/4885PTGS1 988/4885

“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.