SCHEMBL3693702

SCHEMBL3693702

CCC(C(C)=O)(C(=O)O)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.42
HIF1A Q16665 1/20 0.42
CYP1A2 P05177 3/20 0.42
CYP2D6 P10635 1/20 0.40
CES2 O00748 2/20 0.39
CES1 P23141 2/20 0.39
KMT2A Q03164 2/20 0.39
MAPT P10636 1/20 0.39
KIF11 P52732 2/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
DRD2 P14416 1/20 0.39
OPRM1 P35372 1/20 0.39
DRD3 P35462 1/20 0.39
KCNN4 O15554 1/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CHRM2 P08172 1/20 0.37
CHRM1 P11229 1/20 0.37

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
SCHEMBL28901853 0.98 CYP2C19 (0.41) CYP2C19HIF1ACYP1A2CYP2D6CES2
SCHEMBL2291949 0.90 CYP2C19 (0.47) CYP2C19HIF1ACYP1A2CYP2D6KMT2A
SCHEMBL28314575 0.88 CYP2C19 (0.45) CYP2C19HIF1ACYP1A2CYP2D6KMT2A
SCHEMBL28316424 0.88 CYP2C19 (0.45) CYP2C19HIF1ACYP1A2CYP2D6KMT2A
SCHEMBL21269854 0.88 CYP2C19 (0.45) CYP2C19HIF1ACYP1A2CYP2D6KMT2A
SCHEMBL28875698 0.88 CYP2C19 (0.45) CYP2C19HIF1ACYP1A2CYP2D6KMT2A
SCHEMBL21268799 0.88 CYP2C19 (0.45) CYP2C19HIF1ACYP1A2CYP2D6KMT2A
SCHEMBL21269982 0.88 CYP2C19 (0.45) CYP2C19HIF1ACYP1A2CYP2D6KMT2A
SCHEMBL28314775 0.86 CYP2C19 (0.44) CYP2C19HIF1ACYP1A2CYP2D6KMT2A
SCHEMBL28314315 0.86 CYP2C19 (0.44) CYP2C19HIF1ACYP1A2CYP2D6KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160152825-A1 PROCESS FOR PRODUCING COMPOSITES EVONIK DEGUSSA GMBH (DE) 2016-06-02 US claimed
US-11884837-B2 Scratch and mar resistant automotive coatings BASF COATINGS GMBH (DE) 2024-01-30 US disclosed
EP-3655451-B1 LOW TEMPERATURE CURING 1K BASECOAT AND METHOD TO COAT A SUBSTRATE WITH THE 1K BASECOAT BASF COATINGS GMBH (DE) 2023-04-12 EP disclosed
US-11583890-B2 Low temperature curing 1K basecoat and method to coat a substrate with the 1K basecoat BASF COATINGS GMBH (DE) 2023-02-21 US disclosed
EP-3394132-B1 TWO-COMPONENT POLYURETHANE COMPOSITION SIKA TECH AG (CH) 2022-11-09 EP disclosed
US-11459483-B2 Low temperature cure coating formed via polarity-facilitated catalyst migration between layers in a double layer curing mechanism BASF COATINGS GMBH (DE) 2022-10-04 US disclosed
CN-114040775-A Targeted active gene editing agents and methods of use 光点治疗公司 2022-02-11 CN disclosed
CN-114026123-A Targeted active gene editing agents and methods of use 光点治疗公司 2022-02-08 CN disclosed
US-20210371697-A1 Scratch and Mar Resistant Automotive Coatings BASF COATINGS GMBH (DE) 2021-12-02 US disclosed
US-20210371693-A1 TWO-COMPONENT (2K) CLEARCOAT AND METHOD TO COAT A SUBSTRATE WITH THE TWO-COMPONENT (2K) CLEARCOAT HAVING ENHANCED VISUAL APPEARANCE BASF CORPORATION 2021-12-02 US disclosed
EP-1436371-A2 ENZYMATIC SYSTEMS FOR GENERATING ACTIVE OXYGEN SPECIES FOR REACTING WITH OTHER PRECURSORS TO OBTAIN OXIDATION AND/OR BLEACHING Call, Krimhild (DE) 2004-07-14 EP disclosed
WO-2003061550-A2 NOVEL CATALYTIC ACTIVITIES OF OXIDOREDUCTASES FOR OXIDATION AND/OR BLEACHING CALL, KRIMHILD (DE) 2003-07-31 WO disclosed
WO-2002099023-A2 ENZYMATIC SYSTEMS FOR GENERATING ACTIVE OXYGEN SPECIES FOR REACTING WITH OTHER PRECURSORS TO OBTAIN OXIDATION AND/OR BLEACHING CALL, KRIMHILD (DE) 2002-12-12 WO disclosed
US-20020061564-A1 Generating phenylalanine and leucine using mutant enzymatic polypeptide; generate mutant enzyme, aminate ketoacid, recover amino acids CODEXIS, INC. 2002-05-23 US disclosed
WO-2002036742-A2 METHOD FOR CHEMICAL TRANSFORMATION USING A MUTATED ENZYME BIOCATALYTICS, INC. (US) 2002-05-10 WO disclosed
EP-1012376-A2 OXIDATION AND BLEACHING SYSTEM WITH ENZYMATICALLY PRODUCED OXIDIZING AGENTS Blume, Hildegard (DE) 2000-06-28 EP disclosed
WO-1998059108-A2 OXIDATION AND BLEACHING SYSTEM WITH ENZYMATICALLY PRODUCED OXIDIZING AGENTS BLUME, HILDEGARD (DE) 1998-12-30 WO disclosed
US-5597848-A PLATELET AGGREGATION INHIBITORS, ANTITHROMBOTIC AGENTS, ANTIASTHMATIC AGENTS, ANTIALLERGIC AGENTS HOKURIKU SEIYAKU CO., LTD. (JP) 1997-01-28 US disclosed
EP-0699209-A1 PROCESSES AND INTERMEDIATE COMPOUNDS USEFUL FOR THE PREPARATION OF PLATELET GLYCOPROTEIN IIb/IIIa INHIBITORS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1996-03-06 EP disclosed
WO-1994026779-A1 PROCESSES AND INTERMEDIATE COMPOUNDS USEFUL FOR THE PREPARATION OF PLATELET GLYCOPROTEIN IIb/IIIa INHIBITORS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1994-11-24 WO disclosed