SCHEMBL3637037

SCHEMBL3637037

Cc1ccc(C)c(NCc2c[nH]nc2-c2cccs2)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAPT P10636 6/20 0.42
ALDH1A1 P00352 3/20 0.42
LMNA P02545 2/20 0.42
POLB P06746 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
NR1H4 Q96RI1 4/20 0.39
DHFR P00374 1/20 0.39
APP P05067 1/20 0.38
HTT P42858 1/20 0.37

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
SCHEMBL3633954 0.91 MAPT (0.45) GAASMN1; SMN2MAPTALDH1A1LMNA
SCHEMBL3638003 0.87 ADRA2C (0.46) GAASMN1; SMN2L3MBTL1MAPTALDH1A1
SCHEMBL3640227 0.84 NR1H4 (0.45) GAASMN1; SMN2L3MBTL1MAPTALDH1A1
SCHEMBL3633663 0.82 GAA (0.44) GAAL3MBTL1MAPTALDH1A1LMNA
SCHEMBL3639359 0.82 MAPT (0.40) GAASMN1; SMN2MAPTALDH1A1LMNA
SCHEMBL3634725 0.78 SMN1; SMN2 (0.46) GAASMN1; SMN2L3MBTL1MAPTALDH1A1
SCHEMBL3636396 0.77 L3MBTL1 (0.43) GAASMN1; SMN2L3MBTL1MAPTALDH1A1
SCHEMBL3635672 0.77 MAPT (0.39) GAASMN1; SMN2MAPTALDH1A1LMNA
SCHEMBL3638754 0.77 KMT2A (0.41) SMN1; SMN2L3MBTL1MAPTALDH1A1LMNA
SCHEMBL3640421 0.77 GAA (0.43) GAAL3MBTL1MAPTALDH1A1LMNA

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-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
EP-2167464-A1 HETEROCYCLIC COMPOUNDS AS POSITIVE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 (MGLU2 RECEPTOR) Abbott GmbH & Co. KG (DE) 2010-03-31 EP disclosed
WO-2008145616-A1 HETEROCYCLIC COMPOUNDS AS POSITIVE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 (MGLU2 RECEPTOR) ABBOTT GMBH & CO. KG (DE) 2008-12-04 WO 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 GAA 2566/4885SMN1; SMN2 1228/4885L3MBTL1 4483/4885

“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.