SCHEMBL6090299

SCHEMBL6090299

Cc1[nH]c(C=C2C(=O)NN=C2c2cnccn2)cc1CN(C)C

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDR P35968 15/20 0.57
CHEK1 O14757 1/20 0.52

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
SCHEMBL6090271 1.00 KDR (0.57) KDRCHEK1
SCHEMBL6088520 0.85 KDR (0.39) KDRCHEK1
SCHEMBL6088512 0.85 KDR (0.39) KDRCHEK1
SCHEMBL6088730 0.84 KDR (0.37) KDRCHEK1
SCHEMBL6088734 0.84 KDR (0.37) KDRCHEK1
SCHEMBL6090714 0.83 KDR (0.42) KDRCHEK1
SCHEMBL6090720 0.83 KDR (0.42) KDRCHEK1
SCHEMBL6092153 0.82 KDR (0.38) KDRCHEK1
SCHEMBL6092147 0.82 KDR (0.38) KDRCHEK1
SCHEMBL6088112 0.82 KDR (0.36) 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