SCHEMBL45044

SCHEMBL45044

CCC/C(O)=C(/C)C(N)=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 4/20 0.43
HDAC1 Q13547 4/20 0.43
HDAC2 Q92769 4/20 0.43
HDAC8 Q9BY41 4/20 0.43
FFAR3 O14843 3/20 0.43
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
CTSD P07339 1/20 0.37
TSHR P16473 4/20 0.36
ALDH1A1 P00352 3/20 0.35
THRB P10828 1/20 0.34
FNTA P49354 1/20 0.34
FNTB P49356 1/20 0.34
PGGT1B P53609 1/20 0.34
TDP1 Q9NUW8 3/20 0.33
ALOX15 P16050 2/20 0.33
AKR1B1 P15121 1/20 0.33
LMNA P02545 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 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
SCHEMBL1075702 1.00 HDAC3 (0.43) HDAC3HDAC1HDAC2HDAC8FFAR3
SCHEMBL444337 0.86 CES1 (0.44) CES2CES1TSHRALDH1A1THRB
SCHEMBL4593133 0.86 CES1 (0.44) CES2CES1TSHRALDH1A1THRB
Phenol SCHEMBL1415085 0.83 HSD17B3 (0.42) CES2CES1ALDH1A1TDP1LMNA
Phenol SCHEMBL45542 0.83 HSD17B3 (0.42) CES2CES1ALDH1A1TDP1LMNA
SCHEMBL27920516 0.82 GPR84 (0.52) CES2CES1TSHRALDH1A1THRB
SCHEMBL11783133 0.79 HDAC3 (0.48) HDAC3HDAC1HDAC2HDAC8FFAR3
SCHEMBL16664 0.79 HDAC3 (0.48) HDAC3HDAC1HDAC2HDAC8FFAR3
SCHEMBL671878 0.79
SCHEMBL2350817 0.79

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

Appears in 3807 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4329667-B1 IMPLANTABLE DEVICE AND THERAPEUTIC SYSTEM WITH PASSIVE OXYGENATION SANOFI SA (FR) 2026-05-06 EP claimed
EP-3191534-B1 AMPHIPHILIC BLOCK COPOLYMERS FOR DELIVERY OF ACTIVE AGENTS RWTH AACHEN (DE) 2025-10-01 EP claimed
EP-4329670-B1 MANUFACTURING A THERAPEUTIC DEVICE CONTAINING A PLURALITY OF CELLS SANOFI SA (FR) 2025-04-30 EP claimed
EP-3831858-B1 VINYL CHLORIDE-BASED COPOLYMER AND METHOD FOR PREPARING SAME HANWHA SOLUTIONS CORP (KR) 2024-12-04 EP claimed
US-20240156808-A1 Compositions and methods to improve the therapeutic benefit of suboptimally chemical compounds and biological therapies including substituted camptothecins such as irinotecan and topotecan for the treatment of benign and neoplastic hyperproliferative disease conditions, infections, inflammatory and immunological diseases EDISON ONCOLOGY (US) 2024-05-16 US claimed
EP-3817764-B1 BIOPHARMACEUTICAL AGENTS FOR USE IN REDUCING LIPID CONTENT IN CELLS UNIV JOHANNESBURG WITWATERSRAND (ZA) 2024-04-17 EP claimed
EP-4333807-A1 NICOTINAMIDE ADENINE DINUCLEOTIDE (NAD) COMPOSITIONS, METHODS OF MANUFACTURING THEREOF, AND METHODS OF USE THEREOF Sovida Solutions Ltd. (GB) 2024-03-13 EP claimed
EP-3453390-B1 POLYMERIZED DRUG-CONTAINING PHARMACEUTICAL COMPOSITION BIODYNAMIC RES FOUNDATION (JP) 2024-02-14 EP claimed
CN-117529306-A Nicotinamide Adenine Dinucleotide (NAD) compositions, methods of making and methods of using the same 索维达解决方案有限公司 2024-02-06 CN claimed
EP-4308163-A1 PEGYLATED T CELL ENGAGER WITH DUAL SPECIFICITIES TO CD3 AND CD19 Shenzhen Enduring Biotech, Ltd. (CN) 2024-01-24 EP claimed
EP-0688207-A1 LIPID-POLYMER CONJUGATES AND LIPOSOMES SEQUUS PHARMACEUTICALS, INC. (US) 1995-12-27 EP claimed
EP-0683676-A1 DIRECTED BIODISTRIBUTION OF SMALL MOLECULES NEORX CORPORATION (US) 1995-11-29 EP claimed
WO-1994029479-A9 OLIGONUCLEOTIDES WHICH INHIBIT HIV PROTEASE FUNCTION 1995-02-02 WO claimed
WO-1994029479-A1 OLIGONUCLEOTIDES WHICH INHIBIT HIV PROTEASE FUNCTION PHARMAGENICS, INC. (US) 1994-12-22 WO claimed
WO-1994020073-A1 LIPID-POLYMER CONJUGATES AND LIPOSOMES LIPOSOME TECHNOLOGY, INC. (US) 1994-09-15 WO claimed
WO-1994017829-A1 DIRECTED BIODISTRIBUTION OF SMALL MOLECULES NEORX CORPORATION (US) 1994-08-18 WO claimed
EP-0591233-A1 POLYMER COATINGS BIOINTERACTIONS LIMITED (GB) 1994-04-13 EP claimed
WO-1994001448-A1 OLIGONUCLEOTIDES MODIFIED WITH CONJUGATE GROUPS PHARMAGENICS, INC. (US) 1994-01-20 WO claimed
WO-1993023570-A1 OLIGONUCLEOTIDES HAVING CONJUGATES ATTACHED AT THE 2'-POSITION OF THE SUGAR MOIETY PHARMAGENICS, INC. (US) 1993-11-25 WO claimed
WO-1993000391-A1 POLYMER COATINGS BIOINTERACTIONS LIMITED (GB) 1993-01-07 WO claimed