SCHEMBL6316291

SCHEMBL6316291

NC(=O)c1c(-c2ccccn2)noc1NC(=O)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 3/20 0.50
SCN9A Q15858 1/20 0.47
TRPV1 Q8NER1 4/20 0.46
MTOR P42345 1/20 0.42
ABL1 P00519 3/20 0.42
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PTGS2 P35354 1/20 0.41
GABRA5 P31644 1/20 0.40
GRM5 P41594 1/20 0.40

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
SCHEMBL6317827 0.88 TRPV1 (0.56) TLR7TRPV1
SCHEMBL6316069 0.85 GRM1 (0.50) TRPV1MEN1HTTKMT2ASMN1; SMN2
SCHEMBL6315971 0.83 TRPV1 (0.56) TRPV1ABL1MEN1KMT2ASMN1; SMN2
SCHEMBL6316034 0.83 ADORA3 (0.50) TRPV1MEN1KMT2ASMN1; SMN2GABRA5
SCHEMBL6315763 0.82 ABL1 (0.49) TLR7SCN9ATRPV1ABL1MEN1
SCHEMBL6321792 0.82 F2 (0.43) TRPV1MEN1KMT2ASMN1; SMN2GABRA5
SCHEMBL6317180 0.81 ABL1 (0.42) TLR7TRPV1MTORABL1MEN1
SCHEMBL6316594 0.81 ABL1 (0.53) SCN9ATRPV1ABL1
SCHEMBL6316781 0.81 TRPV1 (0.45) TRPV1MTORMEN1HTTKMT2A
SCHEMBL6314799 0.79 SMN1; SMN2 (0.47) MEN1KMT2ASMN1; SMN2GRM5

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 TLR7 1757/4885SCN9A 2978/4885TRPV1 4383/4885

“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.