SCHEMBL6441149

SCHEMBL6441149

CC1=Cc2c(-c3cc(C)cc(C)c3)cccc2C1[Zr]1(C2C(C)=Cc3c(-c4cc(C)cc(C)c4)cccc32)CC1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.33
CREBBP Q92793 1/20 0.33

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
SCHEMBL7046629 0.85 CHRNB2 (0.35) BRD4
Hydrochloric Acid SCHEMBL6063831 0.84 CHRNB2 (0.34) BRD4
SCHEMBL7948081 0.82 HTR1A (0.39)
SCHEMBL6434163 0.81 BRD4 (0.34) BRD4CREBBP
SCHEMBL7049009 0.79 CHRNB2 (0.33) BRD4
SCHEMBL5862311 0.78 BRD9 (0.34) BRD4CREBBP
Hydrochloric Acid SCHEMBL7129750 0.78 CHRNB2 (0.33) BRD4
Hydrochloric Acid SCHEMBL6064049 0.78 CHRNB2 (0.33) BRD4
SCHEMBL9207240 0.78 HTR2C (0.33)
SCHEMBL28878600 0.78 BRD4 (0.32) BRD4CREBBP

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-0968158-B1 METHOD OF PREPARING SUBSTITUTED INDANONES, THE SUBSTITUTED INDANONES AND METALLOCENES PREPARED THEREFROM BASELL POLYOLEFINE GMBH (DE) 2005-08-10 EP disclosed