SCHEMBL7035241

SCHEMBL7035241

CCCC1=Cc2c(-c3ccc(C(C)(C)C)cc3)cccc2C1C(C)(C)C1C(CCC)=Cc2c(-c3ccc(C(C)(C)C)cc3)cccc21

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.32
CREBBP Q92793 1/20 0.32
S1PR1 P21453 1/20 0.31

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
SCHEMBL7035813 0.90 BRD4 (0.33) BRD4CREBBPS1PR1
SCHEMBL7037709 0.85 BRD4 (0.34) BRD4CREBBP
SCHEMBL7036203 0.85 BRD4 (0.32) BRD4CREBBP
SCHEMBL7034541 0.85 BRD4 (0.34) BRD4CREBBP
Hydrochloric Acid SCHEMBL7200620 0.84 BRD4 (0.31) BRD4CREBBP
SCHEMBL7037878 0.82 NPC1 (0.33) BRD4CREBBPS1PR1
Hydrochloric Acid SCHEMBL2526488 0.82 BRD4 (0.31) BRD4CREBBP
SCHEMBL7200621 0.82 BRD4 (0.31) BRD4CREBBP
SCHEMBL2526491 0.81 BRD4 (0.30) BRD4CREBBP
Hydrochloric Acid SCHEMBL6461449 0.81 PARP1 (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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6620953-B1 Complexing dimethylbis(2-methyl-4,5-benzoindenyl)silane with transition metal compounds such as 2,4-di-tert-butylphenoxide, zirconium monochloride, to form polymerization catalysts BASSELL POLYOLEFINE GMBH (DE) 2003-09-16 US disclosed
EP-1133504-B1 METHOD FOR PRODUCING MONOARYLOXY-ANSA-METALLOCENES BASELL POLYOLEFINE GMBH (DE) 2003-03-12 EP disclosed