Benzene

Benzene

SCHEMBL6813157

CC1=C(C)C(C)(C)C([V])=C1C.c1ccccc1

nearest known ligand 0.31

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Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSD P07339 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
SCHEMBL6235822 0.92 CTSD (0.35) CTSD
Hydrochloric Acid SCHEMBL6813959 0.89 CTSD (0.33) CTSD
Hydrochloric Acid SCHEMBL1971877 0.89 CTSD (0.33) CTSD
Hydrochloric Acid SCHEMBL8060243 0.89 CTSD (0.33) CTSD
SCHEMBL2230540 0.69 CTSD (0.43) CTSD
Benzene SCHEMBL4591281 0.68 CTSD (0.31) CTSD
Benzene SCHEMBL219217 0.67 CTSD (0.30) CTSD
Benzene SCHEMBL8467171 0.65
SCHEMBL28961651 0.61 CTSD (0.38) CTSD
SCHEMBL4878222 0.61 CTSD (0.33) CTSD

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0919574-B1 Polymerization catalyst, process for the preparation of conjugated diene polymer in the presence thereof and polybutadiene thus prepared UBE INDUSTRIES (JP) 2004-02-11 EP disclosed
US-6300450-B1 Conjugated diene compound polymerization catalyst process for the preparation of conjugated diene polymer in the presence thereof and polybutadiene thus prepared UBE INDUSTRIES, LTD. (JP) 2001-10-09 US disclosed
EP-0919574-A1 Polymerization catalyst, process for the preparation of conjugated diene polymer in the presence thereof and polybutadiene thus prepared Ube Industries, Ltd. (JP) 1999-06-02 EP disclosed