SCHEMBL6089071

SCHEMBL6089071

CCN(CC)C(C)c1c(C)[nH]c(/C=C2/C(=O)NN=C2C2CC2)c1C

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 2/20 0.36
KDR P35968 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
SCHEMBL6091810 0.80 CHEK1 (0.38) CHEK1KDR
SCHEMBL6090985 0.80 CHEK1 (0.37) CHEK1KDR
SCHEMBL6090679 0.78 CHEK1 (0.49) CHEK1KDR
SCHEMBL6089565 0.78 KDR (0.46) CHEK1KDR
SCHEMBL6089563 0.78 KDR (0.46) CHEK1KDR
SCHEMBL6089341 0.77 KDR (0.46) CHEK1KDR
SCHEMBL6090620 0.77 CHEK1 (0.38) CHEK1KDR
SCHEMBL6090616 0.77 CHEK1 (0.38) CHEK1KDR
SCHEMBL6089074 0.77 KDR (0.59) CHEK1KDR
SCHEMBL6090284 0.77 CHEK1 (0.47) CHEK1KDR

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
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