SCHEMBL5205626

SCHEMBL5205626

C#CCNC(=O)c1ccccc1Nc1ccc2c(C(=N)n3cccc3)n[nH]c2c1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.60
MAPK8 P45983 9/20 0.40
MAPK10 P53779 9/20 0.40
MAPK14 Q16539 9/20 0.40
INSR P06213 1/20 0.39
MET P08581 1/20 0.39
MAP2K7 O14733 1/20 0.36
FNTA P49354 1/20 0.36
FNTB P49356 1/20 0.36
ALK Q9UM73 2/20 0.36
KDM4E B2RXH2 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
PAK1 Q13153 1/20 0.35

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
SCHEMBL5210216 0.90 KDR (0.49) KDRMAPK8MAPK10MAPK14ALK
SCHEMBL5210372 0.87 KDR (0.46) KDRMAPK8MAPK10MAPK14ALK
SCHEMBL5209461 0.85 KDR (0.66) KDRMAPK8MAPK10MAPK14MAP2K7
SCHEMBL5211166 0.85 MAPK8 (0.45) KDRMAPK8MAPK10MAPK14INSR
SCHEMBL5212972 0.83 KDR (0.42) KDRMAPK8MAPK10MAPK14ALK
SCHEMBL5205632 0.80 KDR (0.66) KDRMAPK8MAPK10MAPK14INSR
SCHEMBL5205415 0.75 KDR (1.00) KDRMAPK8MAPK10MAPK14MET
SCHEMBL5205402 0.75 KDR (1.00) KDRMAPK8MAPK10MAPK14MET
SCHEMBL5207861 0.73 KDR (0.85) KDRMAPK8MAPK10MAPK14MET
SCHEMBL5207871 0.73 KDR (0.85) KDRMAPK8MAPK10MAPK14MET

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
EP-1585743-B1 2-(1H-INDAZOL-6-YLAMINO)- BENZAMIDE COMPOUNDS AS PROTEIN KINASES INHIBITORS USEFUL FOR THE TREATMENT OF OPHTHALMIC DISEASES PFIZER (US) 2007-05-23 EP disclosed
US-20060160858-A1 Indazole compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use AGOURON PHARMACEUTICALS INC. 2006-07-20 US disclosed
US-7053107-B2 Indazole compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use AGOURON PHARMACEUTICALS, INC. (US) 2006-05-30 US disclosed
EP-1585743-A1 2-(1H-INDAZOL-6-YLAMINO)- BENZAMIDE COMPOUNDS AS PROTEIN KINASES INHIBITORS USEFUL FOR THE TREATMENT OF OPHTHALMIC DISEASES PFIZER INC. (US) 2005-10-19 EP disclosed
US-20040192735-A1 Indazole compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use AGOURON PHARMACEUTICALS, INC. 2004-09-30 US disclosed
WO-2004056806-A1 2-(1H-INDAZOL-6-YLAMINO)-BENZAMIDE COMPOUNDS AS PROTEIN KINASES INHIBITORS USEFUL FOR THE TREATMENT OF OPHTALMIC DISEASES PFIZER INC. (US) 2004-07-08 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-20040192735-A1 Indazole compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use CDK3, BRAF, CNKSR1 KDR 88/4885MAPK8 257/4885MAPK10 484/4885
US-20060160858-A1 Indazole compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use CDK3, BRAF, CNKSR1 KDR 88/4885MAPK8 257/4885MAPK10 484/4885

“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.