SCHEMBL10364829

SCHEMBL10364829

CCCSc1ccccc1-c1nnc2ccc(Sc3ccccc3CO)cn12

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 1/20 0.46
MAPK11 Q15759 1/20 0.46
MINK1 Q8N4C8 1/20 0.46
MAPK14 Q16539 19/20 0.44

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
SCHEMBL10363175 0.89 FLT1 (0.42) FLT1MAPK11MINK1MAPK14
SCHEMBL15086682 0.87 FLT1 (0.42) FLT1MAPK11MINK1MAPK14
SCHEMBL982075 0.85 FLT1 (0.42) FLT1MAPK11MINK1MAPK14
SCHEMBL4079695 0.79 MAPK14 (0.46) MAPK14
SCHEMBL10364834 0.78 PDE5A (0.39) FLT1MAPK11MINK1MAPK14
SCHEMBL5764666 0.78 MAPK14 (0.42) FLT1MAPK11MINK1MAPK14
SCHEMBL4079593 0.78 MAPK14 (0.40) FLT1MAPK11MINK1MAPK14
SCHEMBL30538004 0.77 FLT1 (0.57) FLT1MAPK11MINK1MAPK14
SCHEMBL4130612 0.77 FLT1 (0.43) FLT1MAPK11MINK1MAPK14
SCHEMBL4132478 0.77 MAPK14 (0.43) FLT1MAPK11MINK1MAPK14

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-8222273-B2 Polymorphic form of a [1,2,4]triazole[4,3-A] pyridine derivative inflammatory diseases PFIZER LIMITED (GB) 2012-07-17 US disclosed
US-20110003848-A1 Polymorphic Form Of A [1,2,4]Triazole[4,3-A] Pyridine Derivative For Treating Inflammatory Diseases PFIZER LIMITED (GB) 2011-01-06 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-20110003848-A1 Polymorphic Form Of A [1,2,4]Triazole[4,3-A] Pyridine Derivative For Treating Inflammatory Diseases CYP1B1, UBE2V1, CYP4B1 FLT1 1543/4885MAPK11 2887/4885MINK1 2168/4885

“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.