SCHEMBL4636099

SCHEMBL4636099

CCCNc1ccc2n[c]sc2n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 2/20 0.39
HCAR3 P49019 1/20 0.38
APP P05067 2/20 0.34
PDE5A O76074 1/20 0.33
ALDH1A1 P00352 3/20 0.33
BLM P54132 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ELANE P08246 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TLR8 Q9NR97 1/20 0.33
FYN P06241 3/20 0.32
RIPK1 Q13546 1/20 0.32
TLR7 Q9NYK1 1/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
BCHE P06276 1/20 0.31
ACHE P22303 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL970352 0.84 HRH3 (0.44) PIM1
SCHEMBL973136 0.78 MAOB (0.49) HCAR3APPMAOB
SCHEMBL4873803 0.70 MAP4K4 (0.38) PIM1HCAR3ALDH1A1KDM4ETLR7
SCHEMBL2892169 0.69 RAB9A (0.39) ALDH1A1KDM4EHPGDSMN1; SMN2LMNA
SCHEMBL17364403 0.66 CHRNB2 (0.51) PIM1HCAR3APPPDE5AALDH1A1
SCHEMBL969519 0.65 PLAU (0.36)
SCHEMBL971212 0.65
SCHEMBL4764029 0.65
SCHEMBL7511217 0.65 NCF1 (0.60) APPPDE5AELANEKDM4ETLR8
SCHEMBL4636102 0.65 KDM6B (0.36) HCAR3PDE5AALDH1A1KDM4ESMN1; SMN2

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-20080287434-A1 New amino-alkyl-amide derivatives as CCR3 receptor ligands SANOFI-AVENTIS (FR) 2008-11-20 US disclosed
EP-1931620-A1 AMINO-ALKYL-AMIDE DERIVATIVES AS CCR3 RECEPTOR LIQUIDS Sanofi-Aventis (FR) 2008-06-18 EP disclosed
WO-2007034252-A1 AMINO-ALKYL-AMIDE DERIVATIVES AS CCR3 RECEPTOR LIQUIDS SANOFI-AVENTIS (FR) 2007-03-29 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-20080287434-A1 New amino-alkyl-amide derivatives as CCR3 receptor ligands CCR3, CCR1, CCR4 PIM1 3833/4885HCAR3 30/4885APP 4263/4885

“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.