SCHEMBL5809750

SCHEMBL5809750

O=C(O)CC(CC(=O)O)(OC(=O)OC(CC(=O)O)(CC(=O)O)C(=O)O)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
CYP2C19 P33261 2/20 0.40
HIF1A Q16665 2/20 0.40
CYP2D6 P10635 1/20 0.40
TSHR P16473 1/20 0.40
HMGCR P04035 1/20 0.36
CHRM1 P11229 1/20 0.36
TBXA2R P21731 1/20 0.36
ADRA1A P35348 1/20 0.36
ACLY P53396 3/20 0.34
CPT2 P23786 2/20 0.33
KDM4E B2RXH2 1/20 0.31
FFAR1 O14842 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL8442298 0.97 ALDH1A1 (0.40) ALDH1A1CYP2C19HIF1ACYP2D6TSHR
SCHEMBL28799874 0.97 ALDH1A1 (0.40) ALDH1A1CYP2C19HIF1ACYP2D6TSHR
SCHEMBL6055783 0.97 ALDH1A1 (0.40) ALDH1A1CYP2C19HIF1ACYP2D6TSHR
SCHEMBL8762186 0.97 ALDH1A1 (0.40) ALDH1A1CYP2C19HIF1ACYP2D6TSHR
Ammonia Solution, Strong SCHEMBL29089408 0.95 ALDH1A1 (0.39) ALDH1A1CYP2C19HIF1ACYP2D6TSHR
SCHEMBL28025181 0.95 ALDH1A1 (0.39) ALDH1A1CYP2C19HIF1ACYP2D6TSHR
Citric Acid SCHEMBL27538183 0.89 ALDH1A1 (0.62) ALDH1A1CYP2C19HIF1ACYP2D6TSHR
SCHEMBL10476520 0.86 TSHR (0.39) ALDH1A1CYP2C19HIF1ACYP2D6TSHR
SCHEMBL1547881 0.84 CYP2C19 (0.46) ALDH1A1CYP2C19HIF1ACYP2D6TSHR
SCHEMBL1641740 0.84 ALDH1A1 (0.42) ALDH1A1CYP2C19HIF1ACYP2D6TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006123207-A2 A KIT FOR INHIBITING GASTRIC ACID SECRETION HAVING AN ADJUSTABLE AMOUNT OF PH REGULATING AGENT VECTA, LTD. (US) 2006-11-23 WO claimed
US-20060135406-A1 Compositions and methods for treating pathologies that necessitate suppression of gastric acid secretion VECTA, LTD. (IL) 2006-06-22 US claimed
EP-1414936-A1 LIQUID DETERGENT COMPOSITIONS WITH LOW-DENSITY PARTICLES The Procter & Gamble Company (US) 2004-05-06 EP claimed
WO-2003014285-A1 LIQUID DETERGENT COMPOSITIONS WITH LOW-DENSITY PARTICLES THE PROCTER & GAMBLE COMPANY (US) 2003-02-20 WO claimed
CN-118169114-A Method for rapidly detecting content of monoammonium phosphate in dry powder extinguishing agent 招商局检测认证(重庆)有限公司 2024-06-11 CN disclosed
CN-113057962-A Novel citric acid bicarbonate hemodialysis dry powder and preparation method thereof 广州骐骥生物科技有限公司 2021-07-02 CN disclosed
CN-113057962-A Novel citric acid bicarbonate hemodialysis dry powder and preparation method thereof 广州骐骥生物科技有限公司 2021-07-02 CN disclosed
EP-0793439-B1 A METHOD FOR WAREWASHING WITHOUT BLEACH UNILEVER NV (NL) 2000-01-26 EP disclosed
EP-0726934-B1 CONTROL OF CALCIUM CARBONATE PRECIPITATION IN AUTOMATIC DISHWASHING PROCTER & GAMBLE (US) 1998-09-02 EP disclosed
US-5786315-A CARBONATE, SODIUM SILICATE, SODIUM CITRATE, CITRIC ACID, SODIUM BORATE, SODIUM HYDROXIDE AND POLYMERS THE PROCTER & GAMBLE COMPANY (US) 1998-07-28 US disclosed
EP-0793439-A1 A METHOD AND COMPOSITION FOR WAREWASHING WITHOUT BLEACH UNILEVER N.V. (NL) 1997-09-10 EP disclosed
EP-0726934-A1 CONTROL OF CALCIUM CARBONATE PRECIPITATION IN AUTOMATIC DISHWASHING THE PROCTER & GAMBLE COMPANY (US) 1996-08-21 EP disclosed
EP-0726935-A1 CONTROL OF CALCIUM CARBONATE PRECIPITATION IN AUTOMATIC DISHWASHING THE PROCTER & GAMBLE COMPANY (US) 1996-08-21 EP disclosed
WO-1996015710-A1 A METHOD AND COMPOSITION FOR WAREWASHING WITHOUT BLEACH UNILEVER N.V. (NL) 1996-05-30 WO disclosed
WO-1995012653-A1 CONTROL OF CALCIUM CARBONATE PRECIPITATION IN AUTOMATIC DISHWASHING THE PROCTER & GAMBLE COMPANY (US) 1995-05-11 WO disclosed
WO-1995012654-A1 CONTROL OF CALCIUM CARBONATE PRECIPITATION IN AUTOMATIC DISHWASHING THE PROCTER & GAMBLE COMPANY (US) 1995-05-11 WO disclosed
EP-0213181-A1 LIQUID DIETARY CALCIUM SUPPLEMENTATION BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1987-03-11 EP disclosed
WO-1986004815-A2 LIQUID DIETARY CALCIUM SUPPLEMENTATION BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1986-08-28 WO disclosed
US-4070400-A MICROBIOCIDES, ALGICIDES MERCK & CO., INC. (US) 1978-01-24 US disclosed