SCHEMBL3202458

SCHEMBL3202458

CC(Br)(CCC1CO1)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.32
TSHR P16473 1/20 0.31
MAPK1 P28482 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
SCHEMBL901032 0.80 ACLY (0.38) ALDH1A1TSHRMAPK1
SCHEMBL3193100 0.80 ALDH1A1 (0.34) ALDH1A1TSHRMAPK1
SCHEMBL6691136 0.79 ALDH1A1 (0.32) ALDH1A1TSHRMAPK1
SCHEMBL6687772 0.77 ALDH1A1 (0.30) ALDH1A1
SCHEMBL6120645 0.73 TSHR (0.42) ALDH1A1TSHR
SCHEMBL16353782 0.71 FFAR1 (0.44) ALDH1A1TSHR
SCHEMBL991397 0.70
SCHEMBL13500045 0.69 ALDH1A1 (0.42) ALDH1A1TSHRMAPK1
SCHEMBL2821051 0.69
SCHEMBL27667888 0.69 CES1 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7678869-B2 Atom or group transfer radical polymerization CARNEGIE MELLON UNIVERSITY (US) 2010-03-16 US disclosed
US-20060258826-A1 Atom or group transfer radical polymerization CARNEGIE MELLON UNIVERSITY 2006-11-16 US disclosed
EP-0966489-B1 IMPROVEMENTS IN ATOM OR GROUP TRANSFER RADICAL POLYMERIZATION UNIV CARNEGIE MELLON (US) 2006-11-15 EP disclosed
US-7125938-B2 Atom or group transfer radical polymerization CARNEGIE MELLON UNIVERSITY (US) 2006-10-24 US disclosed
US-20040204556-A1 Atom or group transfer radical polymerization MATYJASZEWSKI KRZYSZTOF (US) 2004-10-14 US disclosed
US-6541580-B1 Controlling living polymerization via e.g. polyphosphazene initiators CARNEGIE MELLON UNIVERSITY 2003-04-01 US disclosed
US-6512060-B1 Contacting at least one first molecule comprising one or more radically transferable atoms or groups, and at least one second molecule comprising one or more radically transferable atoms or groups with a system comprising: a transition metal, CARNEGIE MELLON UNIVERSITY 2003-01-28 US disclosed
EP-0966489-A4 IMPROVEMENTS IN ATOM OR GROUP TRANSFER RADICAL POLYMERIZATION UNIV CARNEGIE MELLON (US) 2002-03-06 EP disclosed
EP-0966489-A1 IMPROVEMENTS IN ATOM OR GROUP TRANSFER RADICAL POLYMERIZATION CARNEGIE MELLON UNIVERSITY (US) 1999-12-29 EP disclosed
WO-1998040415-A1 IMPROVEMENTS IN ATOM OR GROUP TRANSFER RADICAL POLYMERIZATION CARNEGIE MELLON UNIVERSITY (US) 1998-09-17 WO disclosed