SCHEMBL7948076

SCHEMBL7948076

CCC1C=C(C(C)(C)C)C=C1[Zr](C)(C)(=[SiH2])(Oc1ccc(C)cc1C(C)(C)C)(Oc1ccc(C)cc1C(C)(C)C)C1=CC(C(C)(C)C)=CC1CC

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
LMNA P02545 1/20 0.31
TSHR P16473 1/20 0.30
CASP1 P29466 1/20 0.30
CASP7 P55210 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL7946114 0.85
SCHEMBL7946135 0.80
SCHEMBL7947207 0.77
SCHEMBL9885324 0.65 KMT2A (0.47) MEN1KMT2ALMNATSHRSMN1; SMN2
SCHEMBL7946107 0.62
SCHEMBL7947221 0.62
SCHEMBL7950039 0.61 MEN1 (0.30) MEN1KMT2A
SCHEMBL15349624 0.60 USP2 (0.47) MEN1KMT2ALMNASMN1; SMN2
SCHEMBL7950012 0.60
SCHEMBL3668976 0.60 ALDH1A1 (0.41) MEN1KMT2ALMNATSHRSMN1; SMN2

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-6262286-B1 REACTING AROMATIC TRANSITION METAL COMPLEXES WITH ALKALI OR ALKALI METAL CYCLOPENTADIENYL DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2001-07-17 US disclosed