SCHEMBL4778062

SCHEMBL4778062

O=S(=O)(O)c1ccccc1C=C(Nc1nc(Nc2ccccc2)nc(N2CCOCC2)n1)c1ccccc1S(=O)(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 7/20 0.53
CA1 P00915 7/20 0.53
CA2 P00918 7/20 0.53
CA9 Q16790 7/20 0.53
LMNA P02545 3/20 0.53
HTT P42858 1/20 0.53
POLB P06746 4/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
MAPT P10636 5/20 0.45
GAA P10253 2/20 0.45
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
PIKFYVE Q9Y2I7 1/20 0.43
TP53 P04637 1/20 0.43
NPSR1 Q6W5P4 3/20 0.43
TSHR P16473 2/20 0.42

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
SCHEMBL8663701 0.96 LMNA (0.51) CA12CA1CA2CA9LMNA
SCHEMBL29437100 0.87 CA12 (0.64) CA12CA1CA2CA9LMNA
SCHEMBL5190368 0.87 CA12 (0.64) CA12CA1CA2CA9LMNA
SCHEMBL19611819 0.87 CA12 (0.45) CA12CA1CA2CA9LMNA
SCHEMBL6400413 0.87 TTR (0.40) CA12CA1CA2CA9POLB
SCHEMBL8573230 0.86 LMNA (0.53) CA12CA1CA2CA9LMNA
SCHEMBL16240781 0.82 LMNA (0.42) CA12CA1CA2CA9LMNA
SCHEMBL8654292 0.79 CA1 (0.39) CA12CA1CA2CA9HTT
SCHEMBL4776717 0.79 CA12 (0.53) CA12CA1CA2CA9LMNA
SCHEMBL8057064 0.79 CA12 (0.53) CA12CA1CA2CA9LMNA

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 95 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11015153-B2 Unitary laundry detergent article THE PROCTER & GAMBLE COMPANY (US) 2021-05-25 US claimed
EP-3097171-B1 FLUORESCENT BRIGHTENER PREMIX PROCTER & GAMBLE (US) 2020-06-24 EP claimed
EP-3097171-A1 FLUORESCENT BRIGHTENER PREMIX The Procter & Gamble Company (US) 2016-11-30 EP claimed
WO-2015106449-A1 FLUORESCENT BRIGHTENER PREMIX THE PROCTER & GAMBLE COMPANY (US) 2015-07-23 WO claimed
US-5804543-A SULFONIC ACID-FREE MIXTURE CONTAINING ALKYLPOLYETHOXYLATE SULFATE ANIONIC SURFACTANT, NONIONIC SURFACTANT, BUILDER, AMINE OXIDE-CONTAINING POLYMER DISCOLORATION INHIBITOR THE PROCTER & GAMBLE COMPANY (US) 1998-09-08 US claimed
US-11753608-B2 Water-soluble unit dose articles comprising perfume THE PROCTER & GAMBLE COMPANY (US) 2023-09-12 US disclosed
US-20230279314-A1 LAUNDRY DETERGENT COMPOSITION COMPRISING POLYVINYL ALCOHOL ACETAL POLYMER THE PROCTER & GAMBLE COMPANY 2023-09-07 US disclosed
US-20230250365-A1 FABRIC AND HOME CARE PRODUCT COMPRISING A SULFATIZED ESTERAMINE THE PROCTER & GAMBLE COMPANY 2023-08-10 US disclosed
EP-4123007-A1 FABRIC TREATMENT USING BACTERIAL SPORES The Procter & Gamble Company (US) 2023-01-25 EP disclosed
US-11236235-B2 Leuco compounds MILLIKEN & COMPANY (US) 2022-02-01 US disclosed
US-11208614-B2 Cleaning compositions comprising esteramines and an anionic surfactant THE PROCTER & GAMBLE COMPANY (US) 2021-12-28 US disclosed
US-11193097-B2 Water-soluble unit dose articles comprising enzyme THE PROCTER & GAMBLE COMPANY (US) 2021-12-07 US disclosed
US-5714450-A MIXING DIAMINOSTILBENEDISULFONIC ACID OR DIAMINOSTILBENESULFONIC ACID-CYANURIC CHLORIDE WHITENER WITH SURFACTANT AND PLASTICIZER; REDUCES DEGRADATION OF WHITENER AMWAY CORPORATION (US) 1998-02-03 US disclosed
US-5714452-A WHITENING AGENT AND SURFACTANT AMWAY CORPORATION (US) 1998-02-03 US disclosed
US-5710116-A PEROXYGEN BLEACHES FOR BLEACHING FABRICS THE PROCTER & GAMBLE COMPANY (US) 1998-01-20 US disclosed
US-5686014-A CONTACTING FABRICS IMPREGNATED WITH MANGANESE CONTAINING BLEACH CATALYSTS WITH AN AQUEOUS ACIDIC SOLUTION TO REDUCE THE BLEACH CATALYST CARRY OVER THE PROCTER & GAMBLE COMPANY (US) 1997-11-11 US disclosed
US-5686376-A REDUCING DISCOLORATION CAUSED BY COPPER OR NICKEL DURING LAUNDERING, WHITENING, BRIGHTENING THE PROCTER & GAMBLE COMPANY (US) 1997-11-11 US disclosed
WO-1997010322-A1 BUILDER COMBINATIONS CONTAINING ACROLEIN-VINYL ACETATE COPOLYMERS, DETERGENTS AND CLEANERS CONTAINING THESE AND THEIR PREPARATION HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1997-03-20 WO disclosed
WO-1996022961-A1 ALKOXYSUCCINIC ACID DERIVATIVES, BUILDER COMBINATIONS, DETERGENTS AND CLEANING AGENTS CONTAINING THE LATTER AND PREPARATION THEREOF HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1996-08-01 WO disclosed
US-4150024-A Reaction products of epsilon-caprolactam with vicinal hydroxyalkylamines and alkoxylation products thereof HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1979-04-17 US disclosed