SCHEMBL17807494

SCHEMBL17807494

Fc1ccc(C2=NCCc3sccc32)cc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 1/20 0.50
MAPK10 P53779 1/20 0.44
MAPK14 Q16539 1/20 0.41
PTGS1 P23219 11/20 0.37
PTGS2 P35354 5/20 0.35
JAK2 O60674 1/20 0.35
RET P07949 1/20 0.35
MAP2K1 Q02750 1/20 0.35
MAP4K2 Q12851 1/20 0.35
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL12158615 0.83 NOS2 (0.50) NOS2MAPK10PTGS2MAP2K1MAP4K2
SCHEMBL16865684 0.83 NOS2 (0.50) NOS2MAPK10PTGS2MAP2K1MAP4K2
SCHEMBL17807492 0.83 NOS2 (0.53) NOS2MAPK10PTGS2MAP2K1MAP4K2
SCHEMBL31344191 0.83 NOS2 (0.46) NOS2
SCHEMBL20912486 0.81 MAPK10 (0.49) NOS2MAPK10MAPK14
SCHEMBL12158623 0.80 NOS2 (0.46) NOS2MAP2K1MAP4K2ALDH1A1LMNA
SCHEMBL17807495 0.80 NOS2 (0.46) NOS2ALDH1A1
SCHEMBL16866585 0.75 MAPK10 (0.49) NOS2MAPK10ALDH1A1LMNA
SCHEMBL12158625 0.73 KDM4E (0.40) NOS2MAPK14PTGS1PTGS2ALDH1A1
SCHEMBL4151921 0.71 MAPK10 (0.41) MAPK10MAPK14PTGS1PTGS2JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160164007-A1 ORGANIC METAL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2016-06-09 US disclosed
US-20160164007-A1 ORGANIC METAL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2016-06-09 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-20160164007-A1 ORGANIC METAL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE EMPLOYING THE SAME C5, C9, C1S NOS2 1101/4885MAPK10 2208/4885MAPK14 2414/4885

“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.