SCHEMBL12376849

SCHEMBL12376849

CC(C)(c1ccc(O)c(CN2CCOCC2)c1)c1ccc(O)c(CN2CCOCC2)c1

nearest known ligand 0.74

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 4/20 0.74
TSHR P16473 1/20 0.56
CTSB P07858 1/20 0.56
ALOX15 P16050 2/20 0.53
CYP2C9 P11712 2/20 0.53
HSD17B10 Q99714 1/20 0.53
KLF10 Q13118 1/20 0.53
GAA P10253 2/20 0.48
LMNA P02545 1/20 0.48
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
POLB P06746 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2A13 Q16696 1/20 0.45
ACHE P22303 1/20 0.44

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
SCHEMBL12964747 0.95 CACNA1B (0.84) CACNA1BTSHRCTSBALOX15CYP2C9
SCHEMBL13990610 0.91 TSHR (0.67) CACNA1BTSHRCTSBALOX15CYP2C9
SCHEMBL12964412 0.88 CACNA1B (0.58) CACNA1BTSHRCTSBALOX15CYP2C9
SCHEMBL31060430 0.85 CACNA1B (1.00) CACNA1BTSHRALOX15CYP2C9HSD17B10
SCHEMBL29942189 0.81 CACNA1B (0.54) CACNA1BTSHRCTSBALOX15CYP2C9
SCHEMBL10163424 0.80 ALOX15 (0.65) CACNA1BTSHRCTSBALOX15CYP2C9
SCHEMBL3976297 0.80 TSHR (0.76) CACNA1BTSHRALOX15HSD17B10GAA
SCHEMBL8800403 0.80 CTSB (0.62) TSHRCTSBALOX15CYP2C9HSD17B10
SCHEMBL13990827 0.78 SMN1; SMN2 (0.58) CTSBALOX15CYP2C9HSD17B10GAA
SCHEMBL17084495 0.77 CYP2C9 (0.50) CACNA1BALOX15CYP2C9HSD17B10GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1468331-B1 POLYMERIC MATERIAL CONTAINING A LATENT ACID BASF SE (DE) 2012-10-03 EP disclosed
US-8003297-B2 Polymeric material, containing a latent acid BASF SE (DE) 2011-08-23 US disclosed
US-8003297-B2 Polymeric material, containing a latent acid BASF SE (DE) 2011-08-23 US disclosed
US-20100093950-A1 POLYMERIC MATERIAL, CONTAINING A LATENT ACID CIBA CORPORATION 2010-04-15 US disclosed
US-20100093950-A1 POLYMERIC MATERIAL, CONTAINING A LATENT ACID CIBA CORPORATION 2010-04-15 US disclosed
US-7655380-B2 Polymeric material, containing a latent acid CIBA SPECIALTY CHEMICALS CORPORATION (US) 2010-02-02 US disclosed
US-20090155716-A1 Polymeric material containing a latent acid, i.e. a compound which is not an acid but which can be converted to an acid by the influence of laser irradiation HENEGHAN MICHAEL 2009-06-18 US disclosed
EP-1407322-B1 LASER MARKING METHOD CIBA HOLDING INC (CH) 2008-12-17 EP disclosed
US-7264916-B2 Laser marking method CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-09-04 US disclosed
US-7264916-B2 Laser marking method CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-09-04 US disclosed
US-7198884-B2 Heat stable photocurable resin composition for dry film resist CIBA SPECIALTY CHEMICALS CORP. (US) 2007-04-03 US disclosed
US-7198884-B2 Heat stable photocurable resin composition for dry film resist CIBA SPECIALTY CHEMICALS CORP. (US) 2007-04-03 US disclosed
US-20070054220-A1 Polymeric material, containing a latent acid HENEGHAN MICHAEL 2007-03-08 US disclosed
US-20070054220-A1 Polymeric material, containing a latent acid HENEGHAN MICHAEL 2007-03-08 US disclosed