SCHEMBL4908151

SCHEMBL4908151

CC(C)(C)c1n[nH]cc1CNC(=O)c1cccc(OC2CCCC2)c1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 5/20 0.59
POLB P06746 1/20 0.46
SLC5A7 Q9GZV3 3/20 0.45
KAT6A Q92794 2/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
PABPC1 P11940 1/20 0.43
WDR5 P61964 1/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41

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
SCHEMBL4911611 0.81 GAA (0.47) EPHX2KMT2AGAAHPGD
SCHEMBL3637309 0.81 HDAC4 (0.46) EPHX2GAAHPGD
SCHEMBL4914729 0.78 GAA (0.42) EPHX2KMT2AGAAHPGD
SCHEMBL4915833 0.78 SMN1; SMN2 (0.43) KAT6AKMT2AGAAHPGD
SCHEMBL4916143 0.76 SMN1; SMN2 (0.40) POLBGAAHPGD
SCHEMBL13753880 0.76 EPHX2 (0.60) EPHX2POLBSLC5A7KAT6AMEN1
SCHEMBL20588998 0.74 EPHX2 (1.00) EPHX2
SCHEMBL29828850 0.72 KAT6A (0.60) EPHX2POLBSLC5A7KAT6AMEN1
SCHEMBL13753855 0.71 KAT6A (0.59) EPHX2KAT6AMEN1KMT2ARAB9A
SCHEMBL4914520 0.69 TRPV1 (0.52) POLBMEN1KMT2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9242933-B2 Heterocyclic compounds as positive modulators of metabotropic glutamate receptor 2 (mGlu2 receptor) AbbVie Deutschland GmbH & Co. KG (DE) 2016-01-26 US disclosed
US-20080300260-A1 HETEROCYCLIC COMPOUNDS AS POSITIVE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 (MGLU2 receptor) ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2008-12-04 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 (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-20080300260-A1 HETEROCYCLIC COMPOUNDS AS POSITIVE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 (MGLU2 receptor) GRM2, GRIN2C, GRM1 EPHX2 2119/4885POLB 4225/4885SLC5A7 476/4885

“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.