SCHEMBL2918327

SCHEMBL2918327

CCc1ccc(-c2ccc(-c3ccc(C(=O)C(C)(C)N4CCOCC4)cc3)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
MAPK1 P28482 3/20 0.60
TSHR P16473 1/20 0.60
HRH3 Q9Y5N1 2/20 0.47
MAPT P10636 3/20 0.46
LMNA P02545 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
FKBP1A P62942 1/20 0.45
MCHR1 Q99705 1/20 0.43
TDP1 Q9NUW8 2/20 0.43
POLB P06746 1/20 0.43
CTDSP1 Q9GZU7 1/20 0.43
SLC6A7 Q99884 1/20 0.41
GPR55 Q9Y2T6 1/20 0.41
APC P25054 2/20 0.40

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
SCHEMBL2914565 0.88 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2MAPK1TSHRHRH3
SCHEMBL4185231 0.88 SMN1; SMN2 (0.48) ALDH1A1SMN1; SMN2MAPK1TSHRHRH3
SCHEMBL13657327 0.85 THRA (0.58) ALDH1A1SMN1; SMN2MAPK1TSHRHRH3
SCHEMBL8070009 0.84 ALDH1A1 (0.62) ALDH1A1SMN1; SMN2MAPK1TSHRHRH3
SCHEMBL11340621 0.84 SMN1; SMN2 (0.65) ALDH1A1SMN1; SMN2MAPK1TSHRHRH3
SCHEMBL306032 0.84 ALDH1A1 (0.65) ALDH1A1SMN1; SMN2MAPK1TSHRHRH3
SCHEMBL2917604 0.83 ALDH1A1 (0.63) ALDH1A1SMN1; SMN2MAPK1TSHRHRH3
SCHEMBL307240 0.83 ALDH1A1 (0.63) ALDH1A1SMN1; SMN2MAPK1TSHRHRH3
SCHEMBL3670808 0.82 ALDH1A1 (0.62) ALDH1A1SMN1; SMN2MAPK1TSHRHRH3
SCHEMBL2914899 0.81 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2MAPK1TSHRHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1388538-B1 Polymerisation Initiator MERCK PATENT GMBH (DE) 2010-09-01 EP disclosed
EP-1388538-B1 Polymerisation Initiator MERCK PATENT GMBH (DE) 2010-09-01 EP disclosed
WO-2009125021-A1 STRUCTURED FILMS WITH A CONTROLLED TILTED MOLECULAR ORIENTATION AND SHAPE USING A DICHROIC PHOTOINITIATOR STICHTING DUTCH POLYMER INSTITUTE (NL) 2009-10-15 WO disclosed
EP-2108691-A1 Structured films with a controlled tilted molecular orientation and shape using a dichroic photoinitiator. Stichting Dutch Polymer Institute (NL) 2009-10-14 EP disclosed
US-20080203356-A1 Switchable Narrow Band Reflectors Produced in a Single Curing Step STICHTING DUTCH POLYMER INSTITUTE (NL) 2008-08-28 US disclosed
EP-1825304-A1 SWITCHABLE NARROW BAND REFLECTORS PRODUCED IN A SINGLE CURING STEP Stichting Dutch Polymer Institute (NL) 2007-08-29 EP disclosed
WO-2006085743-A1 SWITCHABLE NARROW BAND REFLECTORS PRODUCED IN A SINGLE CURING STEP STICHTING DUTCH POLYMER INSTITUTE (NL) 2006-08-17 WO disclosed
WO-2006059895-A1 SWITCHABLE NARROW BAND REFLECTORS PRODUCED IN A SINGLE CURING STEP STICHTING DUTCH POLYMER INSTITUTE (NL) 2006-06-08 WO disclosed
EP-1388538-A1 Polymerisation Initiator MERCK PATENT GmbH (DE) 2004-02-11 EP disclosed