SCHEMBL3638240

SCHEMBL3638240

CCCC(=O)c1ccc(NCc2cnc(-c3ccccc3)nc2C)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
HPGD P15428 1/20 0.49
FRK P42685 1/20 0.47
CAMK2B Q13554 1/20 0.47
CAMK2G Q13555 1/20 0.47
CAMK2D Q13557 1/20 0.47
PDE4B Q07343 4/20 0.43
PDE4D Q08499 4/20 0.43
RXRA P19793 2/20 0.43
NR4A2 P43354 2/20 0.43
SLC27A1 Q6PCB7 1/20 0.42
GSK3A P49840 1/20 0.41
GSK3B P49841 1/20 0.41
MAPT P10636 4/20 0.40
ALDH1A1 P00352 4/20 0.40
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40
ATM Q13315 1/20 0.40
GAA P10253 1/20 0.39

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
SCHEMBL3638037 0.77 L3MBTL1 (0.51) SMN1; SMN2L3MBTL1HPGDFRKCAMK2B
SCHEMBL3637367 0.76 SMN1; SMN2 (0.50) SMN1; SMN2L3MBTL1HPGDFRKCAMK2B
SCHEMBL3638458 0.76 SMN1; SMN2 (0.50) SMN1; SMN2L3MBTL1HPGDFRKCAMK2B
SCHEMBL3638402 0.75 SMN1; SMN2 (0.51) SMN1; SMN2L3MBTL1HPGDFRKCAMK2B
SCHEMBL3639418 0.74 SMN1; SMN2 (0.54) SMN1; SMN2L3MBTL1HPGDFRKCAMK2B
SCHEMBL3638704 0.74 HDAC1 (0.56) SMN1; SMN2L3MBTL1HPGDFRKCAMK2B
SCHEMBL3632674 0.74 SMN1; SMN2 (0.50) SMN1; SMN2L3MBTL1HPGDFRKCAMK2B
SCHEMBL3112901 0.74 ALDH1A1 (0.41) SMN1; SMN2L3MBTL1HPGDMAPTALDH1A1
SCHEMBL30814237 0.74 ALDH1A1 (0.41) SMN1; SMN2L3MBTL1HPGDMAPTALDH1A1
SCHEMBL3636234 0.73 PPARA (0.61) SMN1; SMN2L3MBTL1HPGDMAPTLMNA

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 SMN1; SMN2 1228/4885L3MBTL1 4483/4885HPGD 994/4885

“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.