SCHEMBL7009927

SCHEMBL7009927

Cc1c(-c2ccncc2)c(-c2ccc(F)cc2)n2c1CCC2

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.47
RIPK3 Q9Y572 8/20 0.45
MAPK14 Q16539 10/20 0.44
MAPK13 O15264 2/20 0.41
MAPK12 P53778 2/20 0.41
MAPK11 Q15759 2/20 0.41

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
SCHEMBL6291337 1.00 KMT2A (0.47) KMT2ARIPK3MAPK14MAPK13MAPK12
SCHEMBL6291378 0.96 RIPK3 (0.44) KMT2ARIPK3MAPK14MAPK13MAPK12
SCHEMBL6294031 0.90 KMT2A (0.42) KMT2ARIPK3MAPK14
SCHEMBL27492751 0.84 KMT2A (0.47) KMT2ARIPK3MAPK14MAPK13MAPK12
SCHEMBL6476070 0.83 PTGS2 (0.58) KMT2AMAPK14MAPK13MAPK12MAPK11
SCHEMBL6486568 0.81 KMT2A (0.44) KMT2ARIPK3
SCHEMBL6290029 0.81 KMT2A (0.47) KMT2ARIPK3MAPK14MAPK13MAPK12
SCHEMBL6291350 0.81 KMT2A (0.47) KMT2ARIPK3MAPK14MAPK13MAPK12
SCHEMBL6487001 0.81 PTGS2 (0.60) KMT2ARIPK3
SCHEMBL6294032 0.80 KMT2A (0.38) KMT2ARIPK3MAPK14MAPK13MAPK12

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
EP-1252163-B1 4-PYRIDYL-AND 2,4-PYRIMIDINYL-SUBSTITUTED PYRROLE DERIVATIVES AND THEIR USE IN PHARMACY MERCKLE GMBH (DE) 2003-09-24 EP disclosed
US-20030153558-A1 4-Pyridyl-and 2,4-pyrimidinyl-substituted pyrrole derivatives and their use in pharmacy MERCKLE GMBH (DE) 2003-08-14 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-20030153558-A1 4-Pyridyl-and 2,4-pyrimidinyl-substituted pyrrole derivatives and their use in pharmacy IL4, IL2, IL5 KMT2A 4671/4885RIPK3 2758/4885MAPK14 2214/4885

“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.