SCHEMBL6324005

SCHEMBL6324005

CCCCCCCNC(=O)c1c(-c2sccc2C)noc1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
ALDH1A1 P00352 3/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HDAC6 Q9UBN7 5/20 0.40
HDAC1 Q13547 3/20 0.40
NAAA Q02083 2/20 0.40
HDAC3 O15379 2/20 0.40
NCOR2 Q9Y618 2/20 0.40
POLB P06746 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
TP53 P04637 1/20 0.39
MDM2 Q00987 1/20 0.39
HPGD P15428 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
SCHEMBL6316236 1.00 GAA (0.41) GAAL3MBTL1ALDH1A1LMNASMN1; SMN2
SCHEMBL6317489 1.00 GAA (0.41) GAAL3MBTL1ALDH1A1LMNASMN1; SMN2
SCHEMBL6317656 0.99 GAA (0.42) GAAL3MBTL1ALDH1A1LMNASMN1; SMN2
SCHEMBL6324184 0.96 ALDH1A1 (0.44) GAAL3MBTL1ALDH1A1LMNASMN1; SMN2
SCHEMBL6321229 0.90 ALDH1A1 (0.40) GAAL3MBTL1ALDH1A1LMNASMN1; SMN2
SCHEMBL6318930 0.86 POLB (0.39) GAAL3MBTL1ALDH1A1SMN1; SMN2HDAC6
SCHEMBL6315241 0.86 L3MBTL1 (0.53) GAAL3MBTL1ALDH1A1SMN1; SMN2HDAC6
SCHEMBL6318360 0.85 L3MBTL1 (0.57) GAAL3MBTL1ALDH1A1SMN1; SMN2POLB
SCHEMBL6316911 0.84 MEN1 (0.45) GAAL3MBTL1ALDH1A1LMNASMN1; SMN2
SCHEMBL6314609 0.84 TAS1R3 (0.38) L3MBTL1ALDH1A1LMNASMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2005-03-17 US claimed
EP-1435948-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS Pharmacia Italia S.p.A. (IT) 2004-07-14 EP claimed
WO-2003013517-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS PHARMACIA ITALIA S.P.A. (IT) 2003-02-20 WO claimed
US-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2005-03-17 US disclosed
EP-1435948-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS Pharmacia Italia S.p.A. (IT) 2004-07-14 EP disclosed
WO-2003013517-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS PHARMACIA ITALIA S.P.A. (IT) 2003-02-20 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-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors MAP3K9, MAP3K19, MAP4K2 GAA 789/4885L3MBTL1 4176/4885ALDH1A1 4444/4885

“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.