SCHEMBL7950425

SCHEMBL7950425

CN(C)C1=CC([Ti](Cl)(Cl)(NC(C)(C)C)[SiH](C)C)c2ccccc21

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.31
GPR3 P46089 1/20 0.30

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
SCHEMBL7950408 0.87 PTPN1 (0.33)
SCHEMBL7950488 0.80 GAA (0.32)
SCHEMBL7942842 0.77
SCHEMBL29171497 0.77 KMT2A (0.33) KMT2AGPR3
SCHEMBL7952863 0.76 DRD2 (0.31)
SCHEMBL7951047 0.75 TSHR (0.32)
SCHEMBL5611105 0.71
SCHEMBL6907559 0.65 GPR3 (0.33) GPR3
SCHEMBL7949122 0.64 APAF1 (0.33)
SCHEMBL22296664 0.64 PARG (0.31)

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6268444-B1 TITANIUM, ZIRCONIUM OR HAFNIUM COMPOUNDS FOR POLYMERIZATION DOW CHEMICAL COMPANY 2001-07-31 US claimed