SCHEMBL6903036

SCHEMBL6903036

Cc1ccc(C2=Cc3c(-c4ccc(C(C)C)cc4)cccc3C2[Zr]C2C(c3ccc(C)o3)=Cc3c(-c4ccc(C(C)C)cc4)cccc32)o1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.33
BRD4 O60885 1/20 0.31
CREBBP Q92793 1/20 0.31
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 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
SCHEMBL6903740 0.89 GSK3B (0.31) GSK3B
SCHEMBL6902435 0.88 TDP1 (0.36) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6895374 0.88 CHRM2 (0.33) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6898578 0.87 ALDH1A1 (0.37) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6903190 0.86 CHRM2 (0.34) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6903706 0.85 ALDH1A1 (0.31)
SCHEMBL6902288 0.85 EDNRB (0.31)
SCHEMBL6901142 0.84 S1PR1 (0.33) BRD4CREBBP
SCHEMBL16332565 0.84 GSK3B (0.33) GSK3BBRD4CREBBPCHRM2CHRM4
SCHEMBL6904336 0.84 CHRM2 (0.31) CHRM2CHRM4CHRM5CHRM1CHRM3

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
EP-1033371-B1 Transition metal compound, catalyst system, process for the preparation thereof and its use for the polymerization of olefins BASELL POLYOLEFINE GMBH (DE) 2004-01-28 EP claimed