SCHEMBL6324368

SCHEMBL6324368

COc1ccc(-c2noc(N)c2C(=O)NCc2ccccc2C)cn1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
GABRA1 P14867 2/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 4/20 0.42
HPGD P15428 3/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SCN2A Q99250 2/20 0.41
SCN10A Q9Y5Y9 2/20 0.41
LMNA P02545 1/20 0.40
RAB9A P51151 1/20 0.40
TSHR P16473 1/20 0.40
ROCK2 O75116 1/20 0.40
ROCK1 Q13464 1/20 0.40
KLKB1 P03952 1/20 0.40
POLB P06746 1/20 0.39
CDK2 P24941 1/20 0.39
GSK3B P49841 1/20 0.39

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
SCHEMBL6323905 0.90 NPC1 (0.52) MAPTNPC1ALDH1A1HPGDKDM4E
SCHEMBL6317699 0.90 ALDH1A1 (0.45) MAPTGABRA1NPC1ALDH1A1LMNA
SCHEMBL6317197 0.90 LMNA (0.44) MAPTGABRA1NPC1ALDH1A1HPGD
SCHEMBL6315275 0.90 NPC1 (0.48) MAPTGABRA1NPC1ALDH1A1HPGD
SCHEMBL6315873 0.88 BACE1 (0.46) MAPTGABRA1NPC1ALDH1A1LMNA
SCHEMBL6324039 0.87 ALDH1A1 (0.52) MAPTGABRA1ALDH1A1HPGDKDM4E
SCHEMBL6324450 0.87 NTRK1 (0.45) GABRA1NPC1HPGDKDM4ELMNA
SCHEMBL6323365 0.84 CDK2 (0.47) MAPTGABRA1ALDH1A1LMNARAB9A
SCHEMBL6318329 0.83 TSHR (0.55) MAPTNPC1ALDH1A1HPGDKDM4E
SCHEMBL6316080 0.83 ALDH1A1 (0.48) MAPTGABRA1ALDH1A1HPGDKDM4E

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 7 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
CN-1549714-A Aminoisoxazole derivatives active as kinase inhibitors 2004-11-24 CN 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 MAPT 281/4885GABRA1 886/4885NPC1 3741/4885

“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.