SCHEMBL4089463

SCHEMBL4089463

NC(c1ccccn1)c1nc(Cl)nc2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.40
SLC6A2 P23975 4/20 0.38
SLC6A4 P31645 3/20 0.38
SLC6A3 Q01959 3/20 0.38
KDM4E B2RXH2 3/20 0.37
ALDH1A1 P00352 3/20 0.37
MAOA P21397 2/20 0.37
MAOB P27338 1/20 0.37
MAPT P10636 3/20 0.36
APP P05067 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
PDE5A O76074 1/20 0.36
GBA1 P04062 1/20 0.34
CHRM2 P08172 3/20 0.33
CHRM1 P11229 3/20 0.33
KCNH2 Q12809 3/20 0.33
ADRA2A P08913 2/20 0.33
HPGD P15428 2/20 0.33
ADRA1A P35348 2/20 0.33

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
SCHEMBL1062607 0.81 NPC1 (0.46) SLC6A3MEN1KMT2APDE5AGSK3B
SCHEMBL3113119 0.80 MAOA (0.42) SLC6A2KDM4EALDH1A1MAOAMAOB
SCHEMBL3106594 0.76 MAPT (0.42) KDM4EALDH1A1MAOAMAOBMAPT
SCHEMBL3113247 0.73 ALDH1A1 (0.54) KDM4EALDH1A1MAOAMAOBMAPT
SCHEMBL9776728 0.73 ALDH1A1 (0.43) KDM4EALDH1A1MAOAMAOBMAPT
SCHEMBL6210264 0.73 SLC6A2 (0.34) SLC6A2SLC6A4SLC6A3MAPTMEN1
SCHEMBL6214256 0.73 RPS6KA5 (0.37) SLC6A2SLC6A4SLC6A3KDM4EALDH1A1
SCHEMBL3121144 0.73 POLB (0.38) SLC6A2KDM4EALDH1A1MAOAMAOB
SCHEMBL23723285 0.72 APP (0.43) SLC6A2KDM4EALDH1A1MAOAMAOB
SCHEMBL7330670 0.72 APP (0.40) SLC6A2KDM4EALDH1A1MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090062317-A1 MEDICINAL USE OF RECEPTOR LIGANDS 7TM PHARMA A/S (DK) 2009-03-05 US disclosed
EP-1778670-A2 MEDICINAL USE OF RECEPTOR LIGANDS 7TM Pharma A/S (DK) 2007-05-02 EP disclosed
WO-2006010446-A2 MEDICINAL USE OF RECEPTOR LIGANDS 7TM PHARMA A/S (DK) 2006-02-02 WO 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-20090062317-A1 MEDICINAL USE OF RECEPTOR LIGANDS MCHR1, MCHR2, MC1R METAP1 1352/4885SLC6A2 1020/4885SLC6A4 1958/4885

“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.