SCHEMBL6243766

SCHEMBL6243766

CC(C)(C)CNCc1ccc2c(c1)-c1[nH]nc(-c3ccc(C4C=CC(O)=CC4)cc3)c1C2

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 19/20 0.57
KDR P35968 1/20 0.41

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
SCHEMBL4813736 0.83 CHEK1 (0.78) CHEK1
SCHEMBL4810532 0.78 CHEK1 (0.75) CHEK1
SCHEMBL6783261 0.77 CHEK1 (0.78) CHEK1KDR
SCHEMBL4815710 0.73 CHEK1 (1.00) CHEK1
SCHEMBL4807037 0.73 CHEK1 (0.84) CHEK1
SCHEMBL4814833 0.72 CHEK1 (0.70) CHEK1KDR
SCHEMBL4808045 0.72 CHEK1 (0.55) CHEK1KDR
SCHEMBL6794435 0.71 CHEK1 (0.74) CHEK1KDR
SCHEMBL6197873 0.70 CHEK1 (1.00) CHEK1
SCHEMBL6244607 0.69 CHEK1 (0.63) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1603885-A1 FUSED TRI AND TETRA-CYCLIC PYRAZOLE KINASE INHIBITORS Abbott Laboratories (US) 2005-12-14 EP claimed
WO-2004080973-A1 FUSED TRI AND TETRA-CYCLIC PYRAZOLE KINASE INHIBITORS ABBOTT LABORATORIES (US) 2004-09-23 WO claimed