SCHEMBL1329146

SCHEMBL1329146

C=CCCNC(=O)[C@@H]1CCCN1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRCP P42785 3/20 0.57
HTR2C P28335 6/20 0.44
HTR2B P41595 3/20 0.44
TLR2 O60603 2/20 0.40
TERT O14746 1/20 0.40
KDM4E B2RXH2 1/20 0.39
DPP7 Q9UHL4 1/20 0.39
CCNK O75909 1/20 0.38
CDK12 Q9NYV4 1/20 0.38
HTR2A P28223 1/20 0.37
KMT2A Q03164 1/20 0.36

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
SCHEMBL22341244 0.85 PRCP (0.59) PRCPHTR2CHTR2BTLR2TERT
SCHEMBL15329272 0.84 PRCP (0.70) PRCPHTR2CHTR2BTLR2TERT
SCHEMBL9151671 0.83 KMT2A (0.55) PRCPHTR2CHTR2BTLR2TERT
SCHEMBL28750286 0.83 KMT2A (0.55) PRCPHTR2CHTR2BTLR2TERT
SCHEMBL5097625 0.80 PRCP (0.64) PRCPHTR2CHTR2BTLR2TERT
SCHEMBL5735106 0.80 PRCP (0.64) PRCPHTR2CHTR2BTLR2TERT
SCHEMBL4578345 0.80 PRCP (0.64) PRCPHTR2CHTR2BTLR2TERT
SCHEMBL21582234 0.80 PRCP (0.64) PRCPHTR2CHTR2BTLR2TERT
SCHEMBL4578350 0.80 PRCP (0.64) PRCPHTR2CHTR2BTLR2TERT
SCHEMBL2143309 0.79 KMT2A (0.53) PRCPHTR2CHTR2BTLR2TERT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110281845-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2011-11-17 US disclosed
US-7989441-B2 Organic compounds NOVARTIS AG (CH) 2011-08-02 US disclosed
US-20090069294-A1 Organic Compounds NOVARTIS AG (CH) 2009-03-12 US disclosed
EP-1902065-A2 CYCLIC AMIDE DERIVATIVES INHIBITORS OF THE INHIBITOR OF APOPTOSIS PROTEINS, THEIR PREPARATION, AND THEIR USE Novartis AG (CH) 2008-03-26 EP disclosed
WO-2006133147-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2006-12-14 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 (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-20090069294-A1 Organic Compounds XIAP, BAX, MCL1 PRCP 2744/4885HTR2C 3877/4885HTR2B 3562/4885
US-20110281845-A1 ORGANIC COMPOUNDS XIAP, BAX, MCL1 PRCP 2745/4885HTR2C 3876/4885HTR2B 3566/4885

“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.