SCHEMBL6328224

SCHEMBL6328224

Cc1sc(Nc2ccccc2)nc1CC(=O)O

nearest known ligand 0.78

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 7/20 0.78
ALDH1A1 P00352 6/20 0.58
MAPT P10636 9/20 0.57
PTGDR2 Q9Y5Y4 7/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
NPC1 O15118 5/20 0.52
RAB9A P51151 4/20 0.51
HPGD P15428 2/20 0.51
POLB P06746 2/20 0.51
KDM4E B2RXH2 2/20 0.51
DHODH Q02127 1/20 0.48
TP53 P04637 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
GFER P55789 1/20 0.47

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
SCHEMBL11566842 0.79 GAA (0.51) GAAALDH1A1MAPTPTGDR2SMN1; SMN2
SCHEMBL16586316 0.77 GAA (0.63) GAAALDH1A1MAPTPTGDR2SMN1; SMN2
SCHEMBL16047133 0.76 ALDH1A1 (0.61) GAAALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL3618698 0.74 KMT2A (0.56) GAAALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL3537226 0.74 PTGDR2 (0.56) ALDH1A1PTGDR2SMN1; SMN2HPGDPOLB
SCHEMBL14184594 0.73 MEN1 (0.69) GAAALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL21313797 0.73 RAB9A (0.78) GAAALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL17324735 0.73 SMN1; SMN2 (0.76) GAAALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL4765972 0.71 NPC1 (0.76) GAAALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL4400357 0.71 RAB9A (0.86) GAAALDH1A1MAPTSMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6958350-B2 Chemical compounds ASTRAZENECA AB (SE) 2005-10-25 US disclosed
EP-1363902-B1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2004-09-15 EP disclosed
US-20040102483-A1 Chemical compounds ASTRAZENECA AB (SE) 2004-05-27 US disclosed
EP-1363902-A1 CHEMICAL COMPOUNDS AstraZeneca AB (SE) 2003-11-26 EP disclosed
WO-2002066460-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2002-08-29 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-20040102483-A1 Chemical compounds CXCR1, CXCR2, CXCR4 GAA 3524/4885ALDH1A1 684/4885MAPT 3655/4885

“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.