SCHEMBL6079865

SCHEMBL6079865

O=[N+]([O-])c1ccc(Cl)c(COc2ccc(F)nc2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.45
HSD17B10 Q99714 1/20 0.42
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
LMNA P02545 4/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KDM4E B2RXH2 3/20 0.40
NPSR1 Q6W5P4 2/20 0.40
RAB9A P51151 1/20 0.40
ALDH1A1 P00352 1/20 0.39
PKM P14618 1/20 0.39
HSPB1 P04792 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
POLB P06746 1/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
PDE7A Q13946 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 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
SCHEMBL30296395 0.81 INPPL1 (0.41) MAPTKMT2AMEN1KDM4ERAB9A
SCHEMBL6079292 0.80 MAPT (0.64) MAPTHSD17B10KMT2AMEN1LMNA
SCHEMBL28695929 0.78 HSD17B10 (0.58) MAPTHSD17B10KMT2AMEN1LMNA
SCHEMBL6079701 0.78 GRM5 (0.37) KDM4EPOLB
SCHEMBL5571120 0.77 PDE7A (0.61) MAPTHSD17B10KMT2AMEN1LMNA
SCHEMBL6204688 0.75 MAPT (0.57) MAPTKMT2AMEN1LMNASMN1; SMN2
SCHEMBL6205040 0.74 NPC1 (0.49) MAPTHSD17B10KMT2AMEN1LMNA
SCHEMBL29611537 0.72 HSPB1 (0.64) MAPTKMT2AMEN1LMNASMN1; SMN2
SCHEMBL863170 0.72 HSD17B10 (0.55) MAPTHSD17B10KMT2AMEN1LMNA
SCHEMBL16345403 0.72 HSPB1 (0.64) MAPTKMT2AMEN1LMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060063782-A1 3-Hetero arylmethoxy ! pyridines and their analogues as p38 map kinase inhibitors ASTEX THERAPEUTICS LIMITED (GB) 2006-03-23 US disclosed
EP-1545523-A1 3-&-grave;(HETERO) ARYLMETHOXY ! PYRIDINES AND THEIR ANALOGUES ASP38 MAP KINASE INHIBITORS Astex Technology Limited (GB) 2005-06-29 EP disclosed
WO-2005002673-A1 RAF KINASE INHIBITORS ASTEX THERAPEUTICS LIMITED (GB) 2005-01-13 WO disclosed
WO-2004004720-A1 3-`(HETERO) ARYLMETHOXY ! PYRIDINES AND THEIR ANALOGUES AS P38 MAP KINASE INHIBITORS ASTEX TECHNOLOGY LIMITED (GB) 2004-01-15 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-20060063782-A1 3-Hetero arylmethoxy ! pyridines and their analogues as p38 map kinase inhibitors MAPK1, MAPK3, MAPK10 MAPT 2630/4885HSD17B10 753/4885KMT2A 2277/4885

“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.