SCHEMBL4245111

SCHEMBL4245111

CC(C)(C)c1cc(Oc2nnnc(Oc3cc(C(C)(C)C)c(O)c(C(C)(C)C)c3)c2Oc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)cc(C(C)(C)C)c1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.50
CA1 P00915 2/20 0.50
MAPT P10636 2/20 0.42
ALOX15 P16050 2/20 0.42
HPN P05981 1/20 0.42
SIRT5 Q9NXA8 1/20 0.42
SMN1; SMN2 Q16637 4/20 0.41
ALDH1A1 P00352 3/20 0.41
POLB P06746 1/20 0.41
TYR P14679 1/20 0.41
PTGS1 P23219 8/20 0.39
PTGS2 P35354 6/20 0.39
GLRA3 O75311 1/20 0.37
GLRB P48167 1/20 0.37
MEN1 O00255 2/20 0.36
LMNA P02545 2/20 0.36
GAA P10253 2/20 0.36
TSHR P16473 2/20 0.36
KMT2A Q03164 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36

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
SCHEMBL5082754 0.78 CA2 (0.71) CA2CA1MAPTALOX15HPN
SCHEMBL24175648 0.77 CA2 (0.59) CA2CA1MAPTALOX15HPN
SCHEMBL49624 0.74 CA2 (0.61) CA2CA1MAPTALOX15HPN
SCHEMBL10387177 0.74 CA2 (0.57) CA2CA1MAPTALOX15HPN
SCHEMBL10631750 0.72 CA2 (0.63) CA2CA1MAPTALOX15HPN
SCHEMBL4074002 0.70 CA2 (0.46) CA2CA1MAPTALOX15HPN
SCHEMBL3126079 0.69 CA2 (0.53) CA2CA1MAPTALOX15HPN
SCHEMBL7029038 0.69 CA2 (0.53) CA2CA1MAPTALOX15HPN
SCHEMBL5079351 0.68 CA2 (0.57) CA2CA1MAPTALOX15HPN
SCHEMBL30564889 0.68 CA2 (0.52) CA2CA1MAPTALOX15HPN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4456900-A1 RESPIRATORY STIMULANT PARENTERAL FORMULATIONS Enalare Therapeutics Inc. (US) 2024-11-06 EP disclosed
WO-2023227472-A1 POLYCARBONATE COMPOSITION CONTAINING COMBINATION OF HYDROXYPHENYL TRIAZINES AND UV ABSORBERS BASF SE (DE) 2023-11-30 WO disclosed
WO-2023129502-A1 RESPIRATORY STIMULANT PARENTERAL FORMULATIONS ENALARE THERAPEUTICS INC. (US) 2023-07-06 WO disclosed
WO-2009092494-A1 UV-ABSORBENT COORDINATION POLYMER BASF SE (DE) 2009-07-30 WO disclosed
EP-1943236-A2 PROCESS FOR THE SYNTHESIS OF AMINE ETHERS Ciba Holding Inc. (CH) 2008-07-16 EP disclosed
WO-2007042422-A2 PROCESS FOR THE SYNTHESIS OF AMINE ETHERS CIBA HOLDING INC. (CH) 2007-04-19 WO disclosed
EP-1774071-A1 WETTABLE POLYESTER FIBERS AND FABRICS Ciba SC Holding AG (CH) 2007-04-18 EP disclosed
WO-2006008256-A1 WETTABLE POLYESTER FIBERS AND FABRICS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2006-01-26 WO disclosed
EP-1276802-A1 LIQUID STABILIZING MIXTURES FOR ORGANIC POLYMERS Great Lakes Chemical (Europe) GmbH (CH) 2003-01-22 EP disclosed
WO-2001081458-A1 LIQUID STABILIZING MIXTURES FOR ORGANIC POLYMERS GREAT LAKES CHEMICAL (EUROPE) GMBH (CH) 2001-11-01 WO disclosed
EP-0971941-A1 NEW CATALYSTS Ciba SC Holding AG (CH) 2000-01-19 EP disclosed
WO-1998039346-A1 NEW CATALYSTS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1998-09-11 WO disclosed