SCHEMBL3635307

SCHEMBL3635307

CCCC(=O)c1ccc(NCc2cn(C)nc2C)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
NPC1 O15118 3/20 0.46
HPGD P15428 2/20 0.46
MEN1 O00255 1/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46
FRK P42685 1/20 0.46
CAMK2B Q13554 1/20 0.46
CAMK2G Q13555 1/20 0.46
CAMK2D Q13557 1/20 0.46
ALDH1A1 P00352 3/20 0.45
USP2 O75604 1/20 0.43
SLC27A1 Q6PCB7 1/20 0.41
HSD17B3 P37058 1/20 0.41
HTT P42858 1/20 0.39
LMNA P02545 2/20 0.39
TSHR P16473 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KDM4E B2RXH2 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
SCHEMBL3640518 0.88 FRK (0.44) RAB9ASMN1; SMN2NPC1HPGDMEN1
SCHEMBL3637433 0.86 L3MBTL1 (0.48) RAB9ASMN1; SMN2NPC1HPGDMAPT
SCHEMBL3633216 0.78 FRK (0.62) FRKCAMK2BCAMK2GCAMK2D
SCHEMBL3637951 0.78 RAB9A (0.49) RAB9ASMN1; SMN2NPC1HPGDKMT2A
SCHEMBL3634550 0.78 HDAC1 (0.52) RAB9ASMN1; SMN2NPC1HPGDMAPT
SCHEMBL3637892 0.77 SLC27A1 (0.44) RAB9ASMN1; SMN2NPC1HPGDMAPT
SCHEMBL3640387 0.76 FRK (0.44) SMN1; SMN2HPGDMEN1MAPTKMT2A
SCHEMBL3634435 0.76 FRK (0.49) RAB9ASMN1; SMN2NPC1HPGDMEN1
SCHEMBL3640813 0.75 FRK (0.41) RAB9ASMN1; SMN2NPC1HPGDMEN1
SCHEMBL3637505 0.75 SMN1; SMN2 (0.44) SMN1; SMN2HPGDFRKCAMK2BCAMK2G

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 5 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 claimed
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 RAB9A 2325/4885SMN1; SMN2 1228/4885NPC1 2174/4885

“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.