SCHEMBL4124079

SCHEMBL4124079

Nc1n[nH]c2ccc(NC(=O)NCc3cccc(F)c3)cc12

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.69
AURKA O14965 5/20 0.65
AURKB Q96GD4 5/20 0.65
ROCK2 O75116 1/20 0.57
EPHX2 P34913 1/20 0.55
CDK8 P49336 1/20 0.52
JAK2 O60674 3/20 0.52
JAK1 P23458 3/20 0.52
ULK1 O75385 1/20 0.52
LMNA P02545 1/20 0.52
KDR P35968 2/20 0.51
ABL1 P00519 1/20 0.51
LCK P06239 1/20 0.51
FYN P06241 1/20 0.51
CSF1R P07333 1/20 0.51
LYN P07948 1/20 0.51
KIT P10721 1/20 0.51
SRC P12931 1/20 0.51
FLT1 P17948 1/20 0.51
FLT4 P35916 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
SCHEMBL4130093 0.88 AURKA (0.54) MAPK1AURKAAURKBROCK2JAK2
SCHEMBL4124949 0.87 MTOR (0.55) MAPK1AURKAAURKBROCK2JAK2
SCHEMBL4122172 0.87 JAK2 (0.64) MAPK1AURKAAURKBROCK2JAK2
SCHEMBL16564573 0.86 AURKA (0.61) MAPK1AURKAAURKBROCK2JAK2
SCHEMBL4128776 0.84 ROCK2 (0.60) MAPK1AURKAAURKBROCK2LMNA
SCHEMBL16564357 0.83 JAK2 (0.49) MAPK1AURKAAURKBJAK2JAK1
SCHEMBL12907308 0.82 MAPK1 (0.60) MAPK1AURKAAURKBROCK2JAK2
SCHEMBL17095797 0.82 MAPK1 (1.00) MAPK1AURKAAURKB
SCHEMBL3617775 0.81 CDC7 (0.60) MAPK1AURKAAURKBROCK2
SCHEMBL546618 0.79 AURKB (1.00) MAPK1AURKAAURKBCDK8KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2040701-B1 AMINOINDAZOLE UREA DERIVATIVES MERCK PATENT GMBH (DE) 2015-03-18 EP claimed
US-8207210-B2 Aminoindazolylurea derivatives MERCK PATENT GMBH (DE) 2012-06-26 US claimed
US-20090253767-A1 AMINOINDAZOLYLUREA DERIVATIVES MERCK PATENT GESELLSCHAFT (DE) 2009-10-08 US claimed

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-20090253767-A1 AMINOINDAZOLYLUREA DERIVATIVES SGK2, SGK1, SGK3 MAPK1 594/4885AURKA 288/4885AURKB 402/4885

“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.