SCHEMBL5846434

SCHEMBL5846434

CC1=C(C)C(C)(C)C([Nd]C2=C(C)C(C)=C(C)C2(C)C)=C1C

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSD P07339 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
SCHEMBL9452777 1.00 CTSD (0.33) CTSD
SCHEMBL9647777 0.97 CTSD (0.32) CTSD
Hydrochloric Acid SCHEMBL9076662 0.95 CTSD (0.31) CTSD
Hydrochloric Acid SCHEMBL9076958 0.95 CTSD (0.31) CTSD
Hydrochloric Acid SCHEMBL9077515 0.95 CTSD (0.31) CTSD
SCHEMBL2230540 0.73 CTSD (0.43) CTSD
SCHEMBL27956803 0.67 CTSD (0.35) CTSD
SCHEMBL28961651 0.65 CTSD (0.38) CTSD
Hydrochloric Acid SCHEMBL138584 0.65 CTSD (0.33) CTSD
Hydrochloric Acid SCHEMBL20567259 0.65 CTSD (0.39) 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
US-7148299-B2 Polymerization catalyst RIKEN (JP) 2006-12-12 US disclosed
US-20050233894-A1 Polymerization catalyst RIKEN (JP) 2005-10-20 US disclosed
EP-1512700-A1 POLYMERIZATION CATALYST RIKEN (JP) 2005-03-09 EP disclosed