SCHEMBL588612

SCHEMBL588612

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

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.54
SLC13A5 Q86YT5 3/20 0.34
TSHR P16473 5/20 0.32
KDM4E B2RXH2 2/20 0.32
LMNA P02545 2/20 0.32
MAPT P10636 1/20 0.32
ALOX15 P16050 1/20 0.32
TP53 P04637 3/20 0.32
HIF1A Q16665 3/20 0.32
CYP3A4 P08684 2/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
HMGCR P04035 1/20 0.30
CHRM1 P11229 1/20 0.30
TBXA2R P21731 1/20 0.30

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
SCHEMBL588095 0.98 ALDH1A1 (0.52) ALDH1A1SLC13A5TSHRKDM4ELMNA
SCHEMBL588330 0.98 ALDH1A1 (0.52) ALDH1A1SLC13A5TSHRKDM4ELMNA
SCHEMBL588094 0.98 ALDH1A1 (0.52) ALDH1A1SLC13A5TSHRKDM4ELMNA
Water SCHEMBL8392906 0.98 ALDH1A1 (0.52) ALDH1A1SLC13A5TSHRKDM4ELMNA
Ammonia Solution, Strong SCHEMBL589171 0.98 ALDH1A1 (0.52) ALDH1A1SLC13A5TSHRKDM4ELMNA
SCHEMBL588331 0.98 ALDH1A1 (0.52) ALDH1A1SLC13A5TSHRKDM4ELMNA
SCHEMBL588767 0.98 ALDH1A1 (0.52) ALDH1A1SLC13A5TSHRKDM4ELMNA
SCHEMBL588768 0.98 ALDH1A1 (0.52) ALDH1A1SLC13A5TSHRKDM4ELMNA
SCHEMBL4336193 0.85 ALDH1A1 (0.58) ALDH1A1SLC13A5TSHRKDM4ELMNA
SCHEMBL11515455 0.84 ALDH1A1 (0.56) ALDH1A1SLC13A5TSHRKDM4ELMNA

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
US-8114819-B2 Polymers for oilfield applications BAKER HUGHES INCORPORATED (US) 2012-02-14 US claimed
US-20100105580-A1 Polymers For Oilfield Applications BJ SERVICES COMPANY (US) 2010-04-29 US claimed
CN-115710342-B Citric acid-based UV-cured polyurethane acrylate and preparation method and application thereof 华南农业大学 2024-07-16 CN disclosed
CN-115710342-A Citric acid-based UV (ultraviolet) curing polyurethane acrylate as well as preparation method and application thereof 华南农业大学 2023-02-24 CN disclosed
CN-110885409-B Polycarboxylate superplasticizer for slow initial reaction of high-grade concrete and preparation method thereof 云南森博混凝土外加剂有限公司 2022-09-02 CN disclosed
CN-110885409-A Polycarboxylate superplasticizer for slow initial reaction of high-grade concrete and preparation method thereof 云南森博混凝土外加剂有限公司 2020-03-17 CN disclosed
CN-109593167-A A kind of citric acid-modified polycarboxylate water-reducer of sorbierite acrylate and preparation method thereof 贵州铁建恒发新材料科技股份有限公司 2019-04-09 CN disclosed
CN-105820063-B A kind of 4 degree of functionality urethane acrylates based on anhydrous citric acid and its preparation method and application 江苏利田科技股份有限公司 2017-11-17 CN disclosed
US-8114819-B2 Polymers for oilfield applications BAKER HUGHES INCORPORATED (US) 2012-02-14 US disclosed
CN-101888983-A building material composition AGRANA STAERKE GMBH 2010-11-17 CN disclosed
US-20100105580-A1 Polymers For Oilfield Applications BJ SERVICES COMPANY (US) 2010-04-29 US disclosed
US-20050187322-A1 Polyamide resin composition for microcellular foaming injection molding HYUNDAI MOTOR COMPANY (KR) 2005-08-25 US disclosed
CN-1424328-A Solution-stabilized low amylose tapioca flour and its use NAT STARCH CHEM INVEST (US) 2003-06-18 CN disclosed
US-5053339-A Color changing device for monitoring shelf-life of perishable products J P LABS INC. (US) 1991-10-01 US disclosed