SCHEMBL4438210

SCHEMBL4438210

Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1-c1cccc(Nc2ncncc2I)n1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 6/20 0.56
LCK P06239 5/20 0.56
KIT P10721 3/20 0.56
SRC P12931 2/20 0.56
KDR P35968 6/20 0.54
BRAF P15056 8/20 0.53
TEK Q02763 4/20 0.53
POLB P06746 2/20 0.52
MAPT P10636 1/20 0.52
APEX1 P27695 1/20 0.52
RAF1 P04049 5/20 0.52
JAK3 P52333 2/20 0.51
CSF1R P07333 2/20 0.51
DDR2 Q16832 1/20 0.51

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
SCHEMBL4436387 0.86 MAPK14 (0.59) MAPK14LCKKITSRCKDR
SCHEMBL4439915 0.80 BRAF (0.58) MAPK14LCKKITSRCKDR
SCHEMBL4439947 0.80 BRAF (0.60) MAPK14LCKKITSRCKDR
SCHEMBL4446258 0.78 LCK (0.57) MAPK14LCKKITSRCKDR
SCHEMBL2306886 0.77 KDR (0.56) MAPK14LCKKITSRCKDR
SCHEMBL4445668 0.77 KDR (0.62) MAPK14LCKKITSRCKDR
SCHEMBL4438212 0.77 KDR (0.53) MAPK14LCKKITSRCKDR
SCHEMBL3932005 0.75 LCK (0.76) MAPK14LCKKITSRCKDR
Hydrochloric Acid SCHEMBL5488772 0.75 LCK (0.75) MAPK14LCKKITSRCKDR
SCHEMBL4445721 0.74 RAF1 (0.59) BRAFRAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8841318-B2 Substituted heterocycles as janus kinase inhibitors INCYTE CORPORATION (US) 2014-09-23 US disclosed
US-20130274257-A1 SUBSTITUTED HETEROCYCLES AS JANUS KINASE INHIBITORS INCYTE CORPORATION 2013-10-17 US disclosed
US-8513270-B2 Substituted heterocycles as Janus kinase inhibitors INCYTE CORPORATION (US) 2013-08-20 US disclosed
EP-2121692-B1 SUBSTITUTED HETEROCYCLES AS JANUS KINASE INHIBITORS INCYTE CORP (US) 2013-04-10 EP disclosed
EP-2121692-A1 SUBSTITUTED HETEROCYCLES AS JANUS KINASE INHIBITORS Incyte Corporation (US) 2009-11-25 EP disclosed
US-20080188500-A1 e.g. N-[4-methyl-3-(9H-pyrimido[4,5-b]indol-7-yl)phenyl]-3-(trifluoromethyl)benzamide; Janus kinases inhibitor; anticarcinogenic agent; immune-related diseases, skin disorders, myeloid proliferative disorders INCYTE CORPORATION 2008-08-07 US disclosed
WO-2008079965-A1 SUBSTITUTED HETEROCYCLES AS JANUS KINASE INHIBITORS INCYTE CORPORATION (US) 2008-07-03 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 (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-20080188500-A1 e.g. N-[4-methyl-3-(9H-pyrimido[4,5-b]indol-7-yl)phenyl]-3-(trifluoromethyl)benzamide; Janus kinases inhibitor; anticarcinogenic agent; immune-related diseases, skin disorders, myeloid proliferative disorders JAK3, JAK1, JAK2 MAPK14 54/4885LCK 50/4885KIT 1223/4885
US-20130274257-A1 SUBSTITUTED HETEROCYCLES AS JANUS KINASE INHIBITORS JAK1, JAK3, JAK2 MAPK14 80/4885LCK 34/4885KIT 1153/4885

“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.