SCHEMBL6322937

SCHEMBL6322937

NC(=O)c1c(-c2ccncc2)noc1NC(=O)c1cccc(F)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.48
CYP2C19 P33261 1/20 0.48
MAPK14 Q16539 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
TP53 P04637 1/20 0.46
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
PARP1 P09874 1/20 0.43
ADCY1 Q08828 1/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
PKM P14618 1/20 0.42
TSHR P16473 1/20 0.42
RAB9A P51151 1/20 0.42
KCNK3 O14649 1/20 0.41
USP2 O75604 1/20 0.41
KCNQ3 O43525 1/20 0.41
KCNQ2 O43526 1/20 0.41
KCNQ5 Q9NR82 1/20 0.41
HDAC1 Q13547 1/20 0.41

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
SCHEMBL6318554 0.90 MAPK14 (0.47) MAPK14SMN1; SMN2KMT2AMEN1NPC1
SCHEMBL6315634 0.87 FLT3 (0.47) SMN1; SMN2KMT2AMEN1PARP1ALDH1A1
SCHEMBL6318264 0.87 PARP1 (0.43) MAPK14SMN1; SMN2KMT2AMEN1PARP1
SCHEMBL6322794 0.87 NT5E (0.55) SMN1; SMN2KMT2AMEN1ALDH1A1RAB9A
SCHEMBL6319348 0.86 MAPK14 (0.54) MAPK14SMN1; SMN2KMT2AMEN1NPC1
SCHEMBL6321264 0.86 LMNA (0.55) ADCY1ALDH1A1TSHR
SCHEMBL6319728 0.86 TBK1 (0.52) MAPK14SMN1; SMN2TP53KMT2AMEN1
SCHEMBL27609896 0.84 MAPK14 (0.48) CYP1A2CYP2C19MAPK14SMN1; SMN2TP53
SCHEMBL6317501 0.84 MAPT (0.53) SMN1; SMN2TP53KMT2AMEN1PARP1
SCHEMBL6314799 0.83 SMN1; SMN2 (0.47) CYP1A2CYP2C19SMN1; SMN2TP53KMT2A

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 CYP1A2 4402/4885CYP2C19 3888/4885MAPK14 111/4885

“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.