SCHEMBL12424176

SCHEMBL12424176

Cc1ccc(-c2onc(-c3cc(F)cc(F)c3)c2C(O)c2cccnc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.43
ATM Q13315 2/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.39
LMNA P02545 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
GAA P10253 1/20 0.38
CYP17A1 P05093 1/20 0.38
ALDH1A1 P00352 2/20 0.36
TP53 P04637 2/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KCNA5 P22460 1/20 0.34
KCND3 Q9UK17 1/20 0.34
ADRB1 P08588 3/20 0.34
ADRB3 P13945 3/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34

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
SCHEMBL2199594 0.89 KCNA5 (0.41) BRD4ATMKMT2ASMN1; SMN2LMNA
SCHEMBL2198939 0.87 SMN1; SMN2 (0.47) BRD4ATMKMT2ASMN1; SMN2LMNA
SCHEMBL2196056 0.85 ATM (0.49) BRD4ATMKMT2ASMN1; SMN2LMNA
SCHEMBL2197672 0.85 KCNA5 (0.39) BRD4ATMKMT2ASMN1; SMN2LMNA
SCHEMBL2195573 0.85 BRD4 (0.42) BRD4ATMKMT2ASMN1; SMN2LMNA
SCHEMBL2224771 0.84 BRD4 (0.42) BRD4ATMKMT2ASMN1; SMN2LMNA
SCHEMBL2197734 0.83 BRD4 (0.40) BRD4ATMKMT2ASMN1; SMN2LMNA
SCHEMBL2198590 0.83 KCNA5 (0.51) BRD4ATMKMT2ASMN1; SMN2LMNA
SCHEMBL12211362 0.82 BRD4 (0.39) BRD4ATMKMT2ASMN1; SMN2LMNA
SCHEMBL2199164 0.82 BRD4 (0.40) BRD4ATMKMT2ASMN1; SMN2LMNA

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-7977341-B2 For crops; 3-(2,6-Dichlorophenyl)-4-[(3-pyridyl)hydroxymethyl]-5-trimethylsilylisoxazole for example SYNGENTA LIMITED (GB) 2011-07-12 US disclosed
US-7977341-B2 For crops; 3-(2,6-Dichlorophenyl)-4-[(3-pyridyl)hydroxymethyl]-5-trimethylsilylisoxazole for example SYNGENTA LIMITED (GB) 2011-07-12 US disclosed
US-20080096843-A1 Substituted Isoxazoles as Fungicides SYNGENTA LIMITED (GB) 2008-04-24 US disclosed
US-20080096843-A1 Substituted Isoxazoles as Fungicides SYNGENTA LIMITED (GB) 2008-04-24 US disclosed
US-7338967-B2 Substituted isoxazoles as fungicides SYNGENTA LIMITED (GB) 2008-03-04 US disclosed
US-7338967-B2 Substituted isoxazoles as fungicides SYNGENTA LIMITED (GB) 2008-03-04 US 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-20080096843-A1 Substituted Isoxazoles as Fungicides CYP4X1, CYP51A1, CYP3A7 BRD4 3717/4885ATM 3589/4885KMT2A 1843/4885

“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.