SCHEMBL1189016

SCHEMBL1189016

Clc1ccccc1Cc1[c]nccc1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.39
PNMT P11086 1/20 0.39
KMT2A Q03164 1/20 0.39
TAAR1 Q96RJ0 3/20 0.38
AR P10275 1/20 0.36
AOC3 Q16853 1/20 0.36
KCNH2 Q12809 1/20 0.36
DPP4 P27487 1/20 0.36
DAO P14920 1/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
SMN1; SMN2 Q16637 1/20 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
SCHEMBL818602 0.73 CALM1 (0.44) TAAR1LMNA
SCHEMBL1345567 0.72 IDO1 (0.43) IDO1PNMTTAAR1ARAOC3
SCHEMBL29519238 0.71 IDO1 (0.62) IDO1PNMTTAAR1AOC3DAO
SCHEMBL672407 0.71 IDO1 (0.62) IDO1PNMTTAAR1AOC3DAO
SCHEMBL3525295 0.70
SCHEMBL5683250 0.69
SCHEMBL7996362 0.69 TSHR (0.32)
SCHEMBL6165226 0.68 CYP11B1 (0.37) MAPTSMN1; SMN2
SCHEMBL4932093 0.66
SCHEMBL7469721 0.66

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 4 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
EP-2061792-A2 AZETIDINONE DERIVATIVES FOR THE TREATMENT OF DISORDERS OF THE LIPID METABOLISM SCHERING CORPORATION (US) 2009-05-27 EP 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

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 IDO1 2315/4885PNMT 1116/4885KMT2A 3586/4885

“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.