SCHEMBL7599705

SCHEMBL7599705

CCC1=C2c3c(ccc4ccccc34)C1[Zr](C)(C)C1C(CC)=C(c3c1ccc1ccccc31)[Si]2(c1ccccc1)c1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL7597816 0.89 KDM4E (0.32) KDM4EALDH1A1LMNAMAPK1
SCHEMBL7599708 0.86 KDM4E (0.31) KDM4EALDH1A1LMNAMAPK1
SCHEMBL798872 0.85 GAA (0.30)
SCHEMBL7603373 0.83 ALDH1A1 (0.34) KDM4EALDH1A1LMNAMAPK1
Hydrochloric Acid SCHEMBL4326066 0.80 KDM4E (0.32) KDM4EALDH1A1LMNAMAPK1
SCHEMBL7599210 0.80
SCHEMBL7602120 0.80 KDM4E (0.32) KDM4EALDH1A1LMNAMAPK1
SCHEMBL7596999 0.77
SCHEMBL7607532 0.76 SLC6A4 (0.33) KDM4EALDH1A1LMNAMAPK1
SCHEMBL796938 0.75 DRD2 (0.30)

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
US-6410665-B1 POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN BASELL POLYOLEFINE GMBH (DE) 2002-06-25 US claimed
US-6410665-B1 POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN BASELL POLYOLEFINE GMBH (DE) 2002-06-25 US disclosed