SCHEMBL4251604

SCHEMBL4251604

CC[C@H](c1cc2c(Cl)c(C)nn2c(=O)n1Cc1ccccc1)N(CCCN)C(=O)c1ccc(C)cc1

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 20/20 0.65

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
SCHEMBL4251600 1.00 KIF11 (0.65) KIF11
Hydrochloric Acid SCHEMBL4250132 0.99 KIF11 (0.65) KIF11
Hydrochloric Acid SCHEMBL4249019 0.99 KIF11 (0.65) KIF11
Hydrochloric Acid SCHEMBL4250319 0.99 KIF11 (0.65) KIF11
SCHEMBL4252643 0.92 KIF11 (0.56) KIF11
SCHEMBL4252638 0.92 KIF11 (0.56) KIF11
SCHEMBL4244990 0.91 KIF11 (0.62) KIF11
SCHEMBL4244993 0.91 KIF11 (0.62) KIF11
Hydrochloric Acid SCHEMBL4245594 0.91 KIF11 (0.61) KIF11
Hydrochloric Acid SCHEMBL4245599 0.91 KIF11 (0.61) KIF11

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-2035426-A1 PYRAZOLOPYRIMIDONES 4SC AG (DE) 2009-03-18 EP claimed
WO-2007144384-A1 PYRAZOLOPYRIMIDONES 4SC AG (DE) 2007-12-21 WO claimed