SCHEMBL6907986

SCHEMBL6907986

CC1=C(C)C(C)C([Ti](=C(C)C)C2C=Cc3ccccc32)=C1C

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.30
CCL2 P13500 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
SCHEMBL6907934 0.86 MEN1 (0.31)
Hydrochloric Acid SCHEMBL14690463 0.77
SCHEMBL6908587 0.70
Hydrochloric Acid SCHEMBL7645062 0.70 HTR2A (0.33) BRD4CCL2
SCHEMBL1985688 0.69
Hydrochloric Acid SCHEMBL8384026 0.69
Hydrochloric Acid SCHEMBL723051 0.67
SCHEMBL6448190 0.66 BRD4 (0.35) BRD4CCL2
Hydrochloric Acid SCHEMBL1115924 0.66 BRD4 (0.33) BRD4CCL2
SCHEMBL8078360 0.65 HTR2A (0.38) BRD4CCL2

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-6790917-B2 POLYMERIZING A VINYL COMPOUND IN PRESENCE OF A CATALYST OBTAINED BY COMBINING ORGANOTRANSITION METAL COMPOUND, AN ALUMINUM COMPUND OR ALUMOXANE AND A BORON COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-09-14 US disclosed
US-20020198340-A1 Process for producing vinyl compound polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-12-26 US disclosed