SCHEMBL5693454

SCHEMBL5693454

C=C(C)NC(=O)OCCc1cc(-n2nc3ccc(C(F)(F)F)cc3n2)c(O)c(C(C)(C)c2ccccc2)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALOX5 P09917 1/20 0.32
USP2 O75604 2/20 0.31
CYP3A4 P08684 2/20 0.31
NR1I2 O75469 1/20 0.31
ADRB1 P08588 1/20 0.31
HTR1A P08908 1/20 0.31
ADRA2A P08913 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31
CHRM3 P20309 1/20 0.31
SLC6A2 P23975 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
SLC6A4 P31645 1/20 0.31
ADRA1A P35348 1/20 0.31
HRH1 P35367 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
SCHEMBL5693423 0.91 ALOX5 (0.30) LMNASMN1; SMN2ALOX5
SCHEMBL5693449 0.88 ALDH1A1 (0.34) LMNAMAPTSMN1; SMN2ALOX5KMT2A
SCHEMBL13715027 0.83 ALDH1A1 (0.34) LMNAMAPTSMN1; SMN2POLBKMT2A
SCHEMBL13546033 0.83 KDM4E (0.35) LMNASMN1; SMN2POLBKMT2A
SCHEMBL5693426 0.83 FFAR4 (0.33) LMNAALOX5CYP3A4CYP1A2CYP2C9
SCHEMBL16182319 0.82 FFAR1 (0.39)
SCHEMBL2638398 0.81 KDM4E (0.34) LMNAMAPTSMN1; SMN2CYP3A4CYP2D6
SCHEMBL6444240 0.81 NPC1 (0.33) LMNASMN1; SMN2CYP3A4ADORA3CYP2D6
SCHEMBL2637632 0.80 TLR8 (0.34) CYP3A4KCNH2CYP1A2CYP2D6KMT2A
SCHEMBL5693420 0.78 GAA (0.35) LMNASMN1; SMN2ALOX5KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1305320-B1 PHOTOSTABLE, SILYLATED BENZOTRIAZOLE UV ABSORBERS AND COMPOSITIONS STABILIZED THEREWITH CIBA SC HOLDING AG (CH) 2006-05-31 EP disclosed
US-6677392-B2 USED TO STABILIE NATURAL, SEMI-SYNTHETIC OR SYNTHETIC POLYMER. CIBA SPECIALTY CHEMICALS CORPORATION 2004-01-13 US disclosed
EP-1305320-A1 PHOTOSTABLE, SILYLATED BENZOTRIAZOLE UV ABSORBERS AND COMPOSITIONS STABILIZED THEREWITH Ciba SC Holding AG (CH) 2003-05-02 EP disclosed
US-20020115753-A1 Photostable, silylated benzotriazole UV absorbers and compositions stabilized therewith RAVICHANDRAN RAMANATHAN (US) 2002-08-22 US disclosed
WO-2002012252-A1 PHOTOSTABLE, SILYLATED BENZOTRIAZOLE UV ABSORBERS AND COMPOSITIONS STABILIZED THEREWITH CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2002-02-14 WO disclosed