SCHEMBL6088366

SCHEMBL6088366

CCN(CC)Cc1c(C)[nH]c(C=C2C(=O)NN=C2c2cccnn2)c1C1CC1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDR P35968 5/20 0.47
CHEK1 O14757 2/20 0.47

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
SCHEMBL6088360 1.00 KDR (0.47) KDRCHEK1
SCHEMBL6088894 0.91 KDR (0.51) KDRCHEK1
SCHEMBL6088898 0.91 KDR (0.51) KDRCHEK1
SCHEMBL6091070 0.87 KDR (0.58) KDRCHEK1
SCHEMBL6091065 0.87 KDR (0.58) KDRCHEK1
SCHEMBL6090403 0.85 KDR (0.47) KDRCHEK1
SCHEMBL6090411 0.85 KDR (0.47) KDRCHEK1
SCHEMBL6089735 0.85 KDR (0.50) KDRCHEK1
SCHEMBL6089742 0.85 KDR (0.50) KDRCHEK1
SCHEMBL6090342 0.85 KDR (0.47) KDRCHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1218373-A2 2-PYRAZOLIN-5-ONES AS TYROSINE KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2002-07-03 EP claimed
WO-2001009121-A2 2-PYRAZOLIN-5-ONES_AS TYROSINE KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2001-02-08 WO claimed
US-7060822-B1 2-pyrazolin-5-ones ABBOTT GMBH & CO. KG (DE) 2006-06-13 US disclosed
EP-1218373-A2 2-PYRAZOLIN-5-ONES AS TYROSINE KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2002-07-03 EP disclosed
WO-2001009121-A2 2-PYRAZOLIN-5-ONES_AS TYROSINE KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2001-02-08 WO disclosed