SCHEMBL44677

SCHEMBL44677

O=C(O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FABP5 Q01469 3/20 0.59
FABP7 O15540 2/20 0.59
KMT2A Q03164 2/20 0.56
EPHX2 P34913 1/20 0.52
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CASP3 P42574 2/20 0.46
HTR2A P28223 1/20 0.45
MDM4 O15151 1/20 0.43
TP53 P04637 1/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL29381061 1.00 FABP5 (0.59) FABP5FABP7KMT2AEPHX2CA1
SCHEMBL29901230 1.00 FABP5 (0.59) FABP5FABP7KMT2AEPHX2CA1
SCHEMBL30433255 0.93 KMT2A (0.55) FABP5FABP7KMT2AEPHX2CA1
Isothiocyanate SCHEMBL29261606 0.90 FABP5 (0.51) FABP5FABP7KMT2AEPHX2CA1
Isothiocyanate SCHEMBL30858893 0.90 FABP5 (0.51) FABP5FABP7KMT2AEPHX2CA1
SCHEMBL44676 0.86 KMT2A (0.58) FABP5FABP7KMT2AEPHX2CA1
SCHEMBL15981181 0.86 KMT2A (0.58) FABP5FABP7KMT2AEPHX2CA1
SCHEMBL13258633 0.86 FABP5 (0.51) FABP5FABP7KMT2AEPHX2CA1
SCHEMBL7767154 0.86 FABP5 (0.54) FABP5FABP7KMT2AEPHX2CA1
SCHEMBL29598813 0.86 FABP5 (0.54) FABP5FABP7KMT2AEPHX2CA1

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 5428 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260035402-A1 C10-ALKYLENE SUBSTITUTED 13-MEMBERED MACROLIDES AND USES THEREOF ZIKANI THERAPEUTICS INC (US) 2026-02-05 US claimed
EP-3947382-B1 COMPOUNDS FOR USES IN PHARMACOLOGICAL INDUCTION OF HBF FOR TREATMENT OF SICKLE CELL DISEASE AND BETA-THALASSEMIA ACADEMIA SINICA (TW) 2025-09-24 EP claimed
EP-4484439-A1 6'-CYANO-MODIFIED LOCKED NUCLEOSIDE, NUCLEOTIDE, AND NUCLEIC ACID POLYMER Academy of Military Medical Sciences (CN) 2025-01-01 EP claimed
WO-2024234728-A1 6'-CYANO-MODIFIED LOCKED NUCLEOSIDE, NUCLEOTIDE, AND NUCLEIC ACID POLYMER 中国人民解放军军事科学院军事医学研究院 2024-11-21 WO claimed
CN-118791543-A Synthesis of 3' -RNA oligonucleotides 阿尔尼拉姆医药品有限公司 2024-10-18 CN claimed
US-12060334-B2 3-substituted phenazine derivatives as antimicrobial agents UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2024-08-13 US claimed
CN-118369427-A Extrahepatic delivery IRNA compositions and methods of use thereof 阿尔尼拉姆医药品有限公司 2024-07-19 CN claimed
CN-115038790-B Synthesis of 3' -RNA oligonucleotides 阿尔尼拉姆医药品有限公司 2024-06-21 CN claimed
EP-2991655-B1 COMPOSITIONS AND METHODS FOR ALTERING SECOND MESSENGER SIGNALING MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2024-04-10 EP claimed
EP-4337259-A1 COMPOUNDS FOR DEGRADING ALPHA-SYNUCLEIN AGGREGATES AND USES THEREOF Aprinoia Therapeutics Limited (HK) 2024-03-20 EP claimed
US-20020016320-A1 Compounds to treat alzheimer's disease ELAN PHARMACEUTICALS, INC. 2002-02-07 US claimed
WO-2002002506-A2 COMPOUNDS TO TREAT ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2002-01-10 WO claimed
WO-2002002512-A2 COMPOUNDS TO TREAT ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2002-01-10 WO claimed
US-5872101-A Methods of treating neurodegenerative disorders using protease inhibitors SIBIA NEUROSCIENCES, INC. (US) 1999-02-16 US claimed
EP-0800528-A1 PEPTIDE AND PEPTIDE ANALOG PROTEASE INHIBITORS Sibia Neurosciences, Inc. (US) 1997-10-15 EP claimed
US-5637759-A Metal-ligating amino acid derivatives for MRI and for peptide synthesis THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1997-06-10 US claimed
US-5616711-A REACTING BUTENE DERIVATIVE TO AN AMIDE DERIVATIVE; USEFUL AS INTERMEDIATES FOR PRODUCING ANTIULCER DRUGS FUJIREBIO INC. (JP) 1997-04-01 US claimed
WO-1996020725-A2 PEPTIDE, PEPTIDE ANALOG AND AMINO ACID ANALOG PROTEASE INHIBITORS SIBIA NEUROSCIENCES, INC. (US) 1996-07-11 WO claimed
WO-1996020949-A1 PEPTIDE AND PEPTIDE ANALOG PROTEASE INHIBITORS SIBIA NEUROSCIENCES, INC. (US) 1996-07-11 WO claimed
EP-0582304-A2 Methods of producing amino butene derivatives FUJIREBIO Inc. (JP) 1994-02-09 EP claimed