SCHEMBL1645240

SCHEMBL1645240

O=C(O)C(C(=O)O)C1CC1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPN1 P15169 1/20 0.33
CPB2 Q96IY4 1/20 0.33
SLC1A2 P43004 2/20 0.32
SLC1A1 P43005 2/20 0.32
ALOX5 P09917 1/20 0.32
ALDH1A1 P00352 2/20 0.32
TSHR P16473 1/20 0.32
LMNA P02545 1/20 0.32
THRB P10828 1/20 0.32
RECQL P46063 1/20 0.32
EPHX1 P07099 1/20 0.31
ABCB11 O95342 1/20 0.30
F2 P00734 1/20 0.30
TP53 P04637 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30
KMT2A Q03164 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
SCHEMBL5616701 1.00 CPN1 (0.33) CPN1CPB2SLC1A2SLC1A1ALOX5
SCHEMBL7766019 0.89 SHBG (0.41) TSHR
SCHEMBL28379991 0.88 SLC1A2 (0.34) CPN1CPB2SLC1A2SLC1A1ALOX5
SCHEMBL4233684 0.88 EPHX1 (0.39) CPN1CPB2SLC1A2SLC1A1ALDH1A1
SCHEMBL4611368 0.88 EPHX1 (0.44) CPN1CPB2ALDH1A1TSHREPHX1
SCHEMBL7761633 0.87 DPP4 (0.37) CPB2SLC1A2SLC1A1ALOX5EPHX1
SCHEMBL7761639 0.87 DPP4 (0.37) CPB2SLC1A2SLC1A1ALOX5EPHX1
SCHEMBL431289 0.85 EPHX1 (0.48) ALDH1A1EPHX1TP53KDM4EMAPT
SCHEMBL14456397 0.85 EPHX1 (0.48) ALDH1A1EPHX1TP53KDM4EMAPT
SCHEMBL19926140 0.83 CPN1 (0.33) CPN1CPB2SLC1A2SLC1A1ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118908796-A Preparation method of allyl alcohol compound 浙江广厦建设职业技术大学 2024-11-08 CN claimed
EP-0648217-A4 NOVEL SUCROSE LIGANDS, METHODS FOR THEIR PREPARATION, PLATINUM COMPLEXES DERIVED THEREFROM, AND METHODS FOR THEIR USAGE. HAWAIIAN SUGAR PLANTERS ASSOC (US) 1995-06-14 EP claimed
EP-0648217-A1 NOVEL SUCROSE LIGANDS, METHODS FOR THEIR PREPARATION, PLATINUM COMPLEXES DERIVED THEREFROM, AND METHODS FOR THEIR USAGE HAWAIIAN SUGAR PLANTERS' ASSOCIATION (US) 1995-04-19 EP claimed
WO-1994000465-A9 NOVEL SUCROSE LIGANDS, METHODS FOR THEIR PREPARATION, PLATINUM COMPLEXES DERIVED THEREFROM, AND METHODS FOR THEIR USAGE 1994-03-31 WO claimed
WO-1994000465-A1 NOVEL SUCROSE LIGANDS, METHODS FOR THEIR PREPARATION, PLATINUM COMPLEXES DERIVED THEREFROM, AND METHODS FOR THEIR USAGE HAWAIIAN SUGAR PLANTERS' ASSOCIATION (US) 1994-01-06 WO claimed
CN-118908796-A Preparation method of allyl alcohol compound 浙江广厦建设职业技术大学 2024-11-08 CN disclosed
CN-118324695-A Method for selectively preparing quinoline-2-ketone or 3, 4-dihydro-quinoline-2-ketone compound under regulation of photocatalyst 浙江工业大学 2024-07-12 CN disclosed
CN-118307536-A 4, 7-Bis (3, 5-bis (trifluoromethyl) phenyl) -1, 10-phenanthroline framework ligand and synthesis method and application thereof 浙江工业大学 2024-07-09 CN disclosed
CN-116514854-A Ratio type fluorescent probe for simultaneously distinguishing and detecting hypochlorous acid and hydrogen peroxide 郑州大学 2023-08-01 CN disclosed
CN-113880726-A Method for efficiently synthesizing diazo compound 南昌大学 2022-01-04 CN disclosed
CN-108026214-B Vinyl isomerase-dehydratase, enol-dehydratase, linalool-dehydratase and/or crotyl alcohol dehydratase, and preparation and use thereof 基因组股份公司 2021-03-02 CN disclosed
CN-111233884-B Method for synthesizing gamma-butyrolactone containing spiro 1, 3-indandione structure by using microchannel reaction device 南京工业大学 2021-01-26 CN disclosed
US-5338857-A Muscle relaxant MITSUI TOATSU CHEMICALS INCORPORATED (JP) 1994-08-16 US disclosed
WO-1994000465-A9 NOVEL SUCROSE LIGANDS, METHODS FOR THEIR PREPARATION, PLATINUM COMPLEXES DERIVED THEREFROM, AND METHODS FOR THEIR USAGE 1994-03-31 WO disclosed
WO-1994000465-A1 NOVEL SUCROSE LIGANDS, METHODS FOR THEIR PREPARATION, PLATINUM COMPLEXES DERIVED THEREFROM, AND METHODS FOR THEIR USAGE HAWAIIAN SUGAR PLANTERS' ASSOCIATION (US) 1994-01-06 WO disclosed
US-5010200-A Insecticide intermediates IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-04-23 US disclosed
CN-1049660-A Aminoketone derivative and application thereof MITZUI TOATSU CHEMICALS INC (JP) 1991-03-06 CN disclosed
EP-0414391-A2 Aminoketone derivatives and use thereof MITSUI TOATSU CHEMICALS, Inc. (JP) 1991-02-27 EP disclosed
US-4962109-A MITICIDES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-10-09 US disclosed
EP-0295839-A2 Pyrimidine derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-12-21 EP disclosed