SCHEMBL13198260

SCHEMBL13198260

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 2/20 0.49
MAP2K4 P45985 5/20 0.48
EGFR P00533 2/20 0.46
GSK3A P49840 1/20 0.44
GSK3B P49841 1/20 0.44
MAPK1 P28482 5/20 0.42
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
AHR P35869 1/20 0.40
HTT P42858 1/20 0.40
MAPK8 P45983 1/20 0.39
MAPK10 P53779 1/20 0.39
MAPK14 Q16539 1/20 0.39
MAP2K7 O14733 1/20 0.39
TUBB4A P04350 1/20 0.39
TUBB P07437 1/20 0.39
TUBA3C P0DPH7 1/20 0.39
TUBA1B P68363 1/20 0.39
TUBA4A P68366 1/20 0.39

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
SCHEMBL2867399 0.85 EGFR (0.50) NTRK1MAP2K4EGFRGSK3AGSK3B
SCHEMBL13198259 0.85 GSK3B (0.60) NTRK1MAP2K4GSK3AGSK3B
SCHEMBL2863515 0.83 NTRK1 (0.49) NTRK1MAP2K4EGFRGSK3AGSK3B
SCHEMBL13198285 0.82 KDM4E (0.51) MAPK1KDM4EALDH1A1HPGDAHR
SCHEMBL2858421 0.80 MAP2K4 (0.58) NTRK1MAP2K4ALDH1A1MAP2K7
SCHEMBL13198283 0.80 GSK3A (0.45) NTRK1MAP2K4EGFRGSK3AGSK3B
SCHEMBL4335912 0.80 CDK9 (0.49) NTRK1MAP2K4MAPK1MAP2K7
SCHEMBL4326338 0.80 GSK3A (0.45) NTRK1MAP2K4EGFRGSK3AGSK3B
SCHEMBL2855841 0.80 TTK (0.52) NTRK1MAP2K4KDM4EALDH1A1HPGD
SCHEMBL2864251 0.78 MAP2K4 (0.54) NTRK1MAP2K4GSK3AGSK3BMAPK1

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-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

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-20090203691-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 NTRK1 1241/4885MAP2K4 61/4885EGFR 600/4885

“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.