SCHEMBL8207066

SCHEMBL8207066

O=C1NC(c2ccccn2)C12CCNCC2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.44
CRBN Q96SW2 1/20 0.44
ALDH1A1 P00352 10/20 0.41
KDM4E B2RXH2 5/20 0.41
TSHR P16473 4/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
GSK3B P49841 2/20 0.41
HSD17B10 Q99714 6/20 0.39
HPGD P15428 5/20 0.39
CYP1A2 P05177 2/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
USP2 O75604 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
MAPK1 P28482 1/20 0.38
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38

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
SCHEMBL14263429 0.78 HSD11B1 (0.39) DDB1CRBNALDH1A1KDM4ETSHR
SCHEMBL18746129 0.76 MAPT (0.42) DDB1CRBNALDH1A1KDM4ETSHR
SCHEMBL8207921 0.72 GPR119 (0.49) DDB1CRBNTSHRHSD17B10CYP3A4
SCHEMBL12410059 0.68 KMT2A (0.45) KMT2AGSK3BSMN1; SMN2SLC6A9
SCHEMBL29979775 0.65 SLC18A3 (0.50) DDB1CRBNKMT2AMEN1PLD1
SCHEMBL169353 0.65 SLC18A3 (0.50) DDB1CRBNKMT2AMEN1PLD1
SCHEMBL23745244 0.65 DDB1 (0.51) DDB1CRBNALDH1A1KDM4ETSHR
SCHEMBL2563428 0.65 DDB1 (0.51) DDB1CRBNALDH1A1KDM4ETSHR
Hydrochloric Acid SCHEMBL29463791 0.64 SLC18A3 (0.48) DDB1CRBNKMT2AMEN1PLD1
Hydrochloric Acid SCHEMBL4008149 0.64 SLC18A3 (0.48) DDB1CRBNKMT2AMEN1PLD1

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-7884080-B2 Administering an azetidinone compound for treating a disorder of lipid metabolism, pain, diabetes, a vascular condition, demyelination or nonalcoholic fatty liver disease; T-type calcium channel blocking agent, an antagonist of TRPV1, an agonist of TRPV1, of GPR119, antagonist of NPCL1 SCHERING PLOUGH CORPORATION (US) 2011-02-08 US disclosed
US-7884080-B2 Administering an azetidinone compound for treating a disorder of lipid metabolism, pain, diabetes, a vascular condition, demyelination or nonalcoholic fatty liver disease; T-type calcium channel blocking agent, an antagonist of TRPV1, an agonist of TRPV1, of GPR119, antagonist of NPCL1 SCHERING PLOUGH CORPORATION (US) 2011-02-08 US disclosed
US-20080076751-A1 Azetidinone Derivatives and Methods of Use Thereof MERCK SHARP & DOHME CORP. 2008-03-27 US disclosed
US-20080076751-A1 Azetidinone Derivatives and Methods of Use Thereof MERCK SHARP & DOHME CORP. 2008-03-27 US disclosed
WO-2008033464-A2 AZETIDINONE DERIVATIVES FOR THE TREATMENT OF DISORDERS OF THE LIPID METABOLISM SCHERING CORPORATION (US) 2008-03-20 WO disclosed
WO-2008033465-A1 AZETIDINONE DERIVATIVES AND METHODS OF USE THEREOF SCHERING CORPORATION (US) 2008-03-20 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 (1 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-20080076751-A1 Azetidinone Derivatives and Methods of Use Thereof LIPC, ZDHHC20, FABP1 DDB1 2671/4885CRBN 1776/4885ALDH1A1 741/4885

“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.