SCHEMBL5264684

SCHEMBL5264684

CCCSc1ccc(-c2c(-c3ccc(C)cc3)nc3ncccn23)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 8/20 0.42
ALDH1A1 P00352 6/20 0.42
KDM4E B2RXH2 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
RAB9A P51151 2/20 0.42
GLA P06280 1/20 0.42
MAPT P10636 6/20 0.40
MEN1 O00255 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40
HPGD P15428 2/20 0.40
CYP1A2 P05177 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
ROCK2 O75116 1/20 0.39
PIM1 P11309 1/20 0.39
GSK3B P49841 1/20 0.39
AKT1 P31749 1/20 0.39
AKT2 P31751 1/20 0.39
NR1I3 Q14994 1/20 0.38

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
SCHEMBL5261934 0.96 ROCK2 (0.44) GAAALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL5315286 0.90 MAPT (0.46) GAAALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL5261344 0.89 ALDH1A1 (0.51) GAAALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL5264741 0.86 AKT1 (0.39) KDM4ESMN1; SMN2RAB9AMAPTAKT1
SCHEMBL5261473 0.84 GAA (0.44) GAAALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL5265664 0.81 ALDH1A1 (0.53) GAAALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL5266423 0.80 ROCK2 (0.45) GAAALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL5259265 0.79 GAA (0.56) GAAALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL5265356 0.78 GAA (0.41) GAAALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL5262962 0.78 ALDH1A1 (0.41) GAAALDH1A1KDM4ESMN1; SMN2RAB9A

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 3107/4885ALDH1A1 8/4885KDM4E 3211/4885

“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.