SCHEMBL537136

SCHEMBL537136

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

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.42
CYP2C19 P33261 2/20 0.42
TSHR P16473 1/20 0.42
HIF1A Q16665 1/20 0.42
GRM2 Q14416 1/20 0.39
GRM3 Q14832 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HMGCR P04035 1/20 0.39
CHRM1 P11229 1/20 0.39
TBXA2R P21731 1/20 0.39
ADRA1A P35348 1/20 0.39
ACLY P53396 3/20 0.35
CPT2 P23786 2/20 0.35
KDM4E B2RXH2 1/20 0.33
FFAR1 O14842 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL28796367 0.98 TSHR (0.41) CYP2D6CYP2C19TSHRHIF1AGRM2
Succinic Acid SCHEMBL28849007 0.94 CYP2D6 (0.38) CYP2D6CYP2C19TSHRHIF1AGRM2
SCHEMBL16415100 0.89 CYP2D6 (0.38) CYP2D6CYP2C19TSHRHIF1AGRM2
SCHEMBL3667247 0.86 CYP2D6 (0.35) CYP2D6CYP2C19TSHRHIF1AGRM2
SCHEMBL8009657 0.84 CYP2D6 (0.41) CYP2D6CYP2C19TSHRHIF1AGRM2
SCHEMBL10011213 0.82 CYP2D6 (0.33) CYP2D6CYP2C19TSHRHIF1AALDH1A1
SCHEMBL1110756 0.82 AMPD2 (0.36) CYP2D6CYP2C19TSHRHIF1AGRM2
SCHEMBL6230196 0.81 GRM2 (0.37) GRM2GRM3
SCHEMBL14672450 0.80 TSHR (0.38) CYP2D6CYP2C19TSHRHIF1AALDH1A1
SCHEMBL10011026 0.80 MEN1 (0.34) CYP2D6CYP2C19TSHRHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3125879-B1 PHEROMONE COMPOSITIONS INTENDED FOR TREATING STRESS-RELATED BEHAVIOURAL OR MEDICAL DISORDERS IN NON-HUMAN MAMMALS CEVA SANTE ANIMALE (FR) 2020-07-22 EP claimed
EP-2966099-B1 PARTICLE SIZE DISTRIBUTION CONTROL THROUGH INTERNAL DONOR IN ZIEGLER-NATTA CATALYST INDIAN OIL CORP LTD (IN) 2020-03-11 EP claimed
EP-3018150-B1 PROCESS FOR THE PREPARATION OF SPHERICAL CATALYST PARTICLES INDIAN OIL CORP LTD (IN) 2020-03-11 EP claimed
EP-2652115-B1 FLUOROPOLYMER COMPOSITIONS RHODIA CHINA CO LTD (CN) 2019-10-30 EP claimed
EP-3063241-B1 AN AQUEOUS COATING COMPOSTION DOW GLOBAL TECHNOLOGIES LLC (US) 2018-12-19 EP claimed
EP-3162819-B1 IMPROVED ZIEGLER-NATTA CATALYST SYNTHESIS AND PROCESS THEREOF INDIAN OIL CORP LTD (IN) 2018-09-05 EP claimed
EP-2897985-B1 CATALYST FOR POLYMERIZATION OF OLEFINS AND PROCESS THEREOF INDIAN OIL CORP LTD (IN) 2017-03-08 EP claimed
EP-1392638-B1 PROCESS FOR PREPARING ALKYLIDENE SUBSTITUTED SUCCINIC ACID ESTERS BASELL POLIOLEFINE ITALIA SRL (IT) 2016-12-14 EP claimed
US-9444084-B2 Fluoropolymer compositions SOLVAY (CHINA) CO., LTD. (CN) 2016-09-13 US claimed
EP-2652115-A1 FLUOROPOLYMER COMPOSITIONS Rhodia (China) Co., Ltd. (CN) 2013-10-23 EP claimed
US-20130266723-A1 FLUOROPOLYMER COMPOSITIONS RHODIA (CHINA) CO., LTD. (CN) 2013-10-10 US claimed
WO-2012079231-A1 FLUOROPOLYMER COMPOSITIONS RHODIA (CHINA) CO., LTD. (CN) 2012-06-21 WO claimed
WO-2012079506-A1 FLUOROPOLYMER COMPOSITIONS RHODIA (CHINA) CO., LTD. (CN) 2012-06-21 WO claimed
EP-0328158-B1 A METHOD FOR IMPROVING THE RELEASE OF A CAST CONCRETE ITEM FROM THE MOULD BY APPLYING TO THE MOULD A MOULD RELEASE COMPOSITION CASTROL A/S (DK) 1993-06-30 EP claimed
EP-0084689-B1 PROCESS FOR THE MANUFACTURE OF A FOUNDRY CORE OR MOULD AKZO N.V. (NL) 1985-06-12 EP claimed
EP-0050548-B1 QUICK SETTING ADHESIVES COMPRISING AN AQUEOUS LATEX OF PLASTICIZED POLYVINYL ACETATE RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1985-01-16 EP claimed
US-20240359145-A1 PURIFICATION METHODS COMPRISING THE USE OF MEMBRANES OBTAINED FROM BIO-BASED SULFONE POLYMERS SOLVAY SPECIALTYPOLYMERS USA LLC (US) 2024-10-31 US disclosed
CN-116425904-A Supported Ziegler-Natta catalyst and preparation method and application thereof 山东京博石油化工有限公司 2023-07-14 CN disclosed
US-4529716-A Coordination catalyst MONTEDISON S.P.A. (IT) 1985-07-16 US disclosed
EP-0106141-A1 Catalyst components and catalysts for the polymerization of olefins Montedison S.p.A. (IT) 1984-04-25 EP disclosed