SCHEMBL5261906

SCHEMBL5261906

CSc1ccc(-c2nc3ncccn3c2-c2ccc(Cl)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.61
KDM4E B2RXH2 3/20 0.61
ALDH1A1 P00352 3/20 0.61
RAB9A P51151 3/20 0.61
GLA P06280 2/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
MAPT P10636 4/20 0.53
AKT1 P31749 1/20 0.48
AKT2 P31751 1/20 0.48
PTGS1 P23219 2/20 0.47
PTGS2 P35354 2/20 0.47
ROCK2 O75116 2/20 0.46
GSK3B P49841 2/20 0.46
PIM1 P11309 1/20 0.46
NR1I3 Q14994 2/20 0.46
GPBAR1 Q8TDU6 1/20 0.46
EPHB2 P29323 1/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CYP1A2 P05177 1/20 0.43

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
SCHEMBL5264844 0.94 MAPT (0.58) GAAKDM4EALDH1A1RAB9AGLA
SCHEMBL5263728 0.90 AKT1 (0.59) GAAKDM4EALDH1A1RAB9AGLA
SCHEMBL9292401 0.89 MAPT (0.54) GAAKDM4EALDH1A1RAB9AGLA
SCHEMBL5263711 0.88 GAA (0.53) GAAKDM4EALDH1A1RAB9AGLA
SCHEMBL5266872 0.88 MAPT (0.53) GAAKDM4EALDH1A1RAB9AGLA
SCHEMBL6102319 0.88 MAPT (0.53) GAAKDM4EALDH1A1RAB9AGLA
SCHEMBL5261337 0.88 MAPT (0.53) GAAKDM4EALDH1A1RAB9AGLA
SCHEMBL5264443 0.85 ALDH1A1 (0.62) GAAKDM4EALDH1A1RAB9AGLA
SCHEMBL5259806 0.85 ALDH1A1 (0.62) GAAKDM4EALDH1A1RAB9AGLA
SCHEMBL5263051 0.85 MAPT (0.51) GAAKDM4EALDH1A1RAB9AGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1660500-B1 SUBSTITUTED IMIDAZOPYRIMIDINES FOR THE PREVENTION AND TREATMENT OF CANCER S A L V A T LAB SA (ES) 2007-12-12 EP disclosed
US-20060189631-A1 Substituted imidazopyrimidines for the prevention and treatment of cancer LABORATORIOS S.A.L.V.A.T., S.A. (ES) 2006-08-24 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-20060189631-A1 Substituted imidazopyrimidines for the prevention and treatment of cancer BRCA1, CCNA1, DPYD GAA 3107/4885KDM4E 3211/4885ALDH1A1 8/4885

“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.