SCHEMBL4335912

SCHEMBL4335912

COc1cc2[nH]nc(-c3cccc(F)c3)c2cc1NC(=O)Cc1cccnc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CDK9 P50750 1/20 0.49
NTRK1 P04629 1/20 0.46
IDO1 P14902 2/20 0.45
CHEK1 O14757 1/20 0.44
MAP2K4 P45985 3/20 0.43
CLK2 P49760 1/20 0.43
CLK3 P49761 1/20 0.43
DYRK1A Q13627 1/20 0.43
PDE4B Q07343 1/20 0.43
MAPK1 P28482 2/20 0.43
NAMPT P43490 2/20 0.42
PARP14 Q460N5 1/20 0.42
ROCK2 O75116 1/20 0.42
PSMB8 P28062 1/20 0.42
MAP2K7 O14733 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
SCHEMBL4335929 0.88 DYRK1A (0.46) NTRK1MAP2K4CLK2CLK3DYRK1A
SCHEMBL4335949 0.84 CDK9 (0.44) CDK9NTRK1IDO1CLK2CLK3
SCHEMBL2863515 0.83 NTRK1 (0.49) NTRK1MAP2K4CLK2CLK3DYRK1A
SCHEMBL2855841 0.82 TTK (0.52) NTRK1MAP2K4
SCHEMBL2867399 0.81 EGFR (0.50) NTRK1MAP2K4CLK2CLK3DYRK1A
SCHEMBL4329328 0.81 RECQL (0.60) NTRK1MAPK1NAMPTROCK2
SCHEMBL4328003 0.80 CLK2 (0.44) NTRK1IDO1MAP2K4CLK2CLK3
SCHEMBL13198260 0.80 NTRK1 (0.49) NTRK1MAP2K4MAPK1MAP2K7
SCHEMBL13198285 0.79 KDM4E (0.51) MAPK1
SCHEMBL13198259 0.79 GSK3B (0.60) NTRK1MAP2K4CLK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7776890-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-17 US disclosed
US-7776890-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-17 US disclosed
US-20090203691-A1 Novel 1H-indazole compounds OINUMA HITOSHI 2009-08-13 US disclosed
US-20090203691-A1 Novel 1H-indazole compounds OINUMA HITOSHI 2009-08-13 US disclosed
US-7541376-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-02 US disclosed
US-20050282880-A1 Novel 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-12-22 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-20090203691-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 CDK9 303/4885NTRK1 1241/4885IDO1 784/4885
US-20050282880-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 CDK9 303/4885NTRK1 1241/4885IDO1 784/4885

“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.