SCHEMBL4091509

SCHEMBL4091509

O=c1[nH]c(-c2ccnc(F)c2)c(-c2ccc(F)cc2)n1Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.49
MAPK13 O15264 2/20 0.49
MAPK12 P53778 2/20 0.49
MAPK11 Q15759 2/20 0.49
GRIN1 Q05586 5/20 0.43
GRIN2B Q13224 5/20 0.43
RIPK3 Q9Y572 4/20 0.42
KMT2A Q03164 2/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
MEN1 O00255 1/20 0.41
BUB1 O43683 1/20 0.41
DRD2 P14416 1/20 0.41
DRD4 P21917 1/20 0.41
DRD3 P35462 1/20 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
SCHEMBL6509449 0.95 MAPK14 (0.52) MAPK14MAPK13MAPK12MAPK11GRIN1
SCHEMBL13741471 0.80 MAPK1 (0.47) RIPK3KMT2AALDH1A1MEN1BUB1
SCHEMBL4099610 0.77 MAPK14 (0.48) MAPK14MAPK13MAPK12MAPK11KMT2A
SCHEMBL5091878 0.73 TDP1 (0.53) MAPK14MAPK13MAPK12MAPK11RIPK3
SCHEMBL5858727 0.73 MAPK14 (0.52) MAPK14MAPK13MAPK12MAPK11RIPK3
SCHEMBL6583283 0.73 MAPK14 (0.52) MAPK14MAPK13MAPK12MAPK11RIPK3
SCHEMBL4097997 0.70 MAPK14 (0.68) MAPK14MAPK13MAPK12MAPK11MAPT
SCHEMBL5095878 0.69 RIPK3 (0.57) MAPK14RIPK3BUB1
SCHEMBL4466879 0.67 MAPK14 (0.94) MAPK14MAPK13MAPK12MAPK11
SCHEMBL3233018 0.67 MAPK14 (0.43) MAPK14MAPK13MAPK12MAPK11RIPK3

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-20090215766-A1 TETRACYCLIC INHIBITORS OF JANUS KINASES INCYTE CORPORATION 2009-08-27 US disclosed
US-20090215766-A1 TETRACYCLIC INHIBITORS OF JANUS KINASES INCYTE CORPORATION 2009-08-27 US disclosed
US-20090215766-A1 TETRACYCLIC INHIBITORS OF JANUS KINASES INCYTE CORPORATION 2009-08-27 US disclosed
US-20060106020-A1 Tetracyclic inhibitors of Janus kinases INCYTE CORPORATION 2006-05-18 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 (2 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-20090215766-A1 TETRACYCLIC INHIBITORS OF JANUS KINASES JAK1, JAK2, JAK3 MAPK14 136/4885MAPK13 99/4885MAPK12 111/4885
US-20060106020-A1 Tetracyclic inhibitors of Janus kinases JAK1, JAK2, JAK3 MAPK14 136/4885MAPK13 99/4885MAPK12 111/4885

“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.