SCHEMBL3622797

SCHEMBL3622797

CC(C)(C)OC(=O)N1CCC(=O)C(n2cnc(Cl)n2)C1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
ESR2 Q92731 1/20 0.38
GPR119 Q8TDV5 5/20 0.37
PIK3CD O00329 1/20 0.37
DTYMK P23919 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
USP30 Q70CQ3 2/20 0.35
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.35
THRB P10828 1/20 0.35
NR1H2 P55055 1/20 0.35
GRM5 P41594 1/20 0.35
HCAR1 Q9BXC0 1/20 0.34
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34

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
SCHEMBL4121106 0.74 GPR119 (0.43) ESR2GPR119PIK3CDDTYMKUSP30
SCHEMBL14814889 0.72 DDB1 (0.41) GPR119DTYMKMEN1KMT2AMAPT
SCHEMBL3117816 0.72 USP2 (0.42) ESR2GPR119MEN1KMT2AMAPT
SCHEMBL16985388 0.72 MAPT (0.44) ESR2GPR119USP30MAPTNR1H2
SCHEMBL30232424 0.71 PDK4 (0.47) ESR2GPR119DTYMKUSP30NR1H2
SCHEMBL29203225 0.71 PDK4 (0.47) ESR2GPR119DTYMKUSP30NR1H2
SCHEMBL31561924 0.70 USP2 (0.44) ESR2GPR119MEN1KMT2AMAPT
SCHEMBL104498 0.70 USP2 (0.44) ESR2GPR119MEN1KMT2AMAPT
SCHEMBL21241481 0.70 USP2 (0.44) ESR2GPR119MEN1KMT2AMAPT
SCHEMBL12908934 0.70 USP2 (0.44) ESR2GPR119MEN1KMT2AMAPT

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-20100286181-A1 PYRROLE DERIVATIVES WITH ANTIBACTERIAL ACTIVITY ASTRAZENECA AB (SE) 2010-11-11 US disclosed
CN-101558066-A Pyrrole derivatives with antibacterial activity ASTRAZENECA AB (SE) 2009-10-14 CN disclosed
EP-2064209-A1 PYRROLE DERIVATIVES WITH ANTIBACTERIAL ACTIVITY AstraZeneca AB (SE) 2009-06-03 EP disclosed
WO-2008020222-A1 PYRROLE DERIVATIVES WITH ANTIBACTERIAL ACTIVITY ASTRAZENECA AB (SE) 2008-02-21 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-20100286181-A1 PYRROLE DERIVATIVES WITH ANTIBACTERIAL ACTIVITY PGLS, UROD, GMPS POLB 42/4885ESR2 3787/4885GPR119 4408/4885

“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.