SCHEMBL337373

SCHEMBL337373

O=C1NCCCN2CCC[C@@H]12

nearest known ligand 0.85

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.85
KDM4E B2RXH2 3/20 0.85
L3MBTL1 Q9Y468 2/20 0.42
CHRNA7 P36544 1/20 0.34
MAPT P10636 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
GAA P10253 1/20 0.34
MEN1 O00255 1/20 0.34
APEX1 P27695 1/20 0.34
KMT2A Q03164 1/20 0.34
POLB P06746 1/20 0.33
GHSR Q92847 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CCR2 P41597 1/20 0.32

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
SCHEMBL337396 0.92 ALDH1A1 (1.00) ALDH1A1KDM4EL3MBTL1CHRNA7MAPT
SCHEMBL337149 0.92 ALDH1A1 (1.00) ALDH1A1KDM4EL3MBTL1CHRNA7MAPT
SCHEMBL7383705 0.90 ALDH1A1 (0.75) ALDH1A1KDM4EL3MBTL1TDP1GAA
SCHEMBL11329761 0.88 ALDH1A1 (0.72) ALDH1A1KDM4EL3MBTL1MAPTTDP1
SCHEMBL13165143 0.87 KDM4E (0.66) ALDH1A1KDM4EL3MBTL1CHRNA7MAPT
SCHEMBL2115680 0.86 ALDH1A1 (0.89) ALDH1A1KDM4EL3MBTL1TDP1MEN1
SCHEMBL16062994 0.84 KDM4E (0.62) ALDH1A1KDM4EL3MBTL1
SCHEMBL25687896 0.84 ALDH1A1 (0.85) ALDH1A1KDM4EL3MBTL1MAPTTDP1
SCHEMBL25598757 0.84 ALDH1A1 (0.85) ALDH1A1KDM4EL3MBTL1MAPTTDP1
SCHEMBL2301305 0.83 ALDH1A1 (0.71) ALDH1A1KDM4EL3MBTL1MAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11583538-B2 Substituted pyrrolo[1,2-a]pyrazines and pyrrolo[1,2-a][1,4]diazepines as TREX1 inhibitors Venenum Biodesign, LLC (US) 2023-02-21 US disclosed
US-20210015829-A1 CYCLIC TREX1 INHIBITORS Venenum Biodesign, LLC (US) 2021-01-21 US disclosed
US-8097618-B2 Pyridine derivatives and their use in the treatment of psychotic disorders GLAXOSMITHKLINE LLC (US) 2012-01-17 US disclosed
US-20110190276-A1 Pyridine Derivatives And Their Use In The Treatment Of Psychotic Disorders KaNDy Therapeutics Limited (GB) 2011-08-04 US disclosed
EP-2336136-A1 Pyridine derivatives and their use in the treatment of psychotic disorders GlaxoSmithKline LLC (US) 2011-06-22 EP disclosed
US-7919491-B2 Pyridine derivatives and their use in the treatment of psychotic disorders GLAXOSMITHKLINE LLC (US) 2011-04-05 US disclosed
US-20100152175-A1 Pyridine Derivatives and Their Use in The Treatment of Psychotic Disorders GLAXOSMITHKLINE LLC (US) 2010-06-17 US disclosed
US-7683056-B2 Pyridine derivatives and their use in the treatment of psychotic disorders GLAXOSMITHKLINE LLC (US) 2010-03-23 US disclosed
US-20080269208-A1 Pyridine Derivatives and Their Use in the Treatment of Psychotic Disorders KaNDy Therapeutics Limited (GB) 2008-10-30 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 (5 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-20110190276-A1 Pyridine Derivatives And Their Use In The Treatment Of Psychotic Disorders NDUFB7, NDUFB6, GABRE ALDH1A1 337/4885KDM4E 3462/4885L3MBTL1 3970/4885
US-11583538-B2 Substituted pyrrolo[1,2-a]pyrazines and pyrrolo[1,2-a][1,4]diazepines as TREX1 inhibitors TMX1, P2RX1, TCOF1 ALDH1A1 664/4885KDM4E 2540/4885L3MBTL1 3293/4885
US-20210015829-A1 CYCLIC TREX1 INHIBITORS TMX1, TSNAX, TPX2 ALDH1A1 1307/4885KDM4E 2466/4885L3MBTL1 1933/4885
US-20080269208-A1 Pyridine Derivatives and Their Use in the Treatment of Psychotic Disorders SLC6A3, NDUFS5, NDUFB6 ALDH1A1 490/4885KDM4E 1960/4885L3MBTL1 4767/4885
US-20100152175-A1 Pyridine Derivatives and Their Use in The Treatment of Psychotic Disorders CHRNA7, NR3C2, CHRNA6 ALDH1A1 1956/4885KDM4E 4100/4885L3MBTL1 2427/4885

“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.