SCHEMBL7925294

SCHEMBL7925294

CCC(C)C1=C(C(C)CC)CC=C1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
Hydrochloric Acid SCHEMBL8447440 0.79 TSHR (0.31) TSHR
SCHEMBL8135096 0.79
SCHEMBL12814498 0.79 TSHR (0.37) TSHR
SCHEMBL12814743 0.77
SCHEMBL15915249 0.77 TSHR (0.32) TSHR
SCHEMBL2352027 0.77 TSHR (0.32) TSHR
SCHEMBL2340393 0.77 TSHR (0.32) TSHR
SCHEMBL28461244 0.77 TSHR (0.32) TSHR
SCHEMBL5089666 0.77 TSHR (0.32) TSHR
SCHEMBL29199156 0.77 TSHR (0.32) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6232516-B1 Process for cyclopentadiene substitution DSM N.V. (NL) 2001-05-15 US disclosed
US-6124488-A ACTIVE AS CATALYST COMPONENTS, IN PARTICULAR FOR THE POLYMERIZATION OF OLEFINS. DSM N.V. (NL) 2000-09-26 US disclosed
US-6072067-A Cyclopentadiene compound substituted with a hetero atom-containing group DSM N.V. (NL) 2000-06-06 US disclosed
EP-0805142-B1 Cyclopentadiene compound substituted with a hetero atom-containing group DSM NV (NL) 1999-03-24 EP disclosed
EP-0900192-A1 SYNTHESIS OF AN AMINE-CONTAINING CYCLOPENTADIENE DSM N.V. (NL) 1999-03-10 EP disclosed
EP-0900195-A1 CYCLOPENTADIENE COMPOUND SUBSTITUTED WITH BRANCHED ALKYL GROUPS DSM N.V. (NL) 1999-03-10 EP disclosed
EP-0805133-B1 Process for cyclopentadiene substitution DSM NV (NL) 1998-10-07 EP disclosed
WO-1997042162-A1 CYCLOPENTADIENE COMPOUND SUBSTITUTED WITH BRANCHED ALKYL GROUPS DSM N.V. (NL) 1997-11-13 WO disclosed
WO-1997042151-A1 CYCLOPENTADIENE COMPOUND SUBSTITUTED BY CHIRAL GROUPS DSM N.V. (NL) 1997-11-13 WO disclosed
WO-1997042158-A1 SYNTHESIS OF A SUBSTITUTED CYCLOPENTADIENE COMPOUND DSM N.V. (NL) 1997-11-13 WO disclosed
WO-1997042157-A1 SYNTHESIS OF AN AMINE-CONTAINING CYCLOPENTADIENE DSM N.V. (NL) 1997-11-13 WO disclosed
EP-0805133-A1 Process for cyclopentadiene substitution DSM N.V. (NL) 1997-11-05 EP disclosed
EP-0805142-A1 Cyclopentadiene compound substituted with a hetero atom-containing group DSM N.V. (NL) 1997-11-05 EP disclosed