SCHEMBL7783972

SCHEMBL7783972

C=CCOC(=O)CCC(C)C

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.64
TSHR P16473 4/20 0.55
SMN1; SMN2 Q16637 2/20 0.41
PKM P14618 1/20 0.41
CA1 P00915 2/20 0.40
ALDH1A1 P00352 4/20 0.40
GAA P10253 1/20 0.40
CYP3A4 P08684 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
PTPN1 P18031 1/20 0.36
HSD17B10 Q99714 2/20 0.35
EPHX2 P34913 1/20 0.35
MAPT P10636 1/20 0.34
CACNA1B Q00975 1/20 0.34
APBA1 Q02410 1/20 0.34
KDM4E B2RXH2 1/20 0.34
HPGD P15428 1/20 0.34
FAAH O00519 1/20 0.33
MGLL Q99685 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
SCHEMBL28931215 0.89 TSHR (0.61) TDP1TSHRSMN1; SMN2PKMALDH1A1
SCHEMBL28550279 0.85 TSHR (0.67) TDP1TSHRSMN1; SMN2PKMALDH1A1
SCHEMBL29910307 0.85 TSHR (0.67) TDP1TSHRSMN1; SMN2PKMALDH1A1
SCHEMBL14930703 0.85 TSHR (0.51) TDP1TSHRSMN1; SMN2PKMALDH1A1
SCHEMBL8909059 0.85 TSHR (0.51) TDP1TSHRSMN1; SMN2PKMALDH1A1
SCHEMBL18561873 0.83 TSHR (0.54) TDP1TSHRSMN1; SMN2PKMALDH1A1
SCHEMBL11837701 0.83 TSHR (0.50) TDP1TSHRSMN1; SMN2PKMALDH1A1
SCHEMBL7172818 0.83 TSHR (0.50) TDP1TSHRSMN1; SMN2PKMALDH1A1
SCHEMBL28422713 0.83 TSHR (0.54) TDP1TSHRSMN1; SMN2PKMALDH1A1
SCHEMBL18561874 0.83 TSHR (0.54) TDP1TSHRSMN1; SMN2PKMALDH1A1

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-221710989-U Volatilizing product for electric fan 大日本除虫菊株式会社 2024-09-17 CN disclosed
US-20170015659-A1 Prodrugs of NH-Acidic Compounds JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2017-01-19 US disclosed
WO-2011001052-A1 NOVEL CONJUGATES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-01-06 WO disclosed
EP-1141044-A1 SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION, CATALYST FOR OLEFIN POLYMERIZATION AND PROCESS FOR PRODUCING OLEFIN POLYMER Basell Technology Company B.V. (NL) 2001-10-10 EP disclosed
WO-2001036496-A1 SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION, CATALYST FOR OLEFIN POLYMERIZATION AND PROCESS FOR PRODUCING OLEFIN POLYMER BASELL TECHNOLOGY COMPANY B.V. (NL) 2001-05-25 WO disclosed
EP-0717053-B1 Catalyst for olefin polymerization and process for producing polyolefin using the same JAPAN POLYOLEFINS CO LTD (JP) 2001-03-14 EP disclosed
US-6096844-A COMPRISING A TITANIUM COMPOUND, A MAGNESIUM COMPOUND, AND A HALOGEN COMPOUND, AN ORGANOALUMINUM COMPOUND, AN ORGANOSILICON COMPOUND JAPAN POLYOLEFINS CO., LTD. (JP) 2000-08-01 US disclosed
US-5849654-A Catalyst for olefin polymerization and process for producing polyolefin using the same JAPAN POLYOLEFINS CO., LTD. (JP) 1998-12-15 US disclosed
EP-0578473-B1 Catalyst for polymerization of olefin and process for producing olefin polymer SHOWA DENKO KK (JP) 1997-11-19 EP disclosed
EP-0717053-A2 Catalyst for olefin polymerization and process for producing polyolefin using the same JAPAN POLYOLEFINS CO., LTD. (JP) 1996-06-19 EP disclosed
US-5476825-A Consists of magnesium, titanium and halogen compounds, an organoaluminum compound, a reaction product of organoaluminum or organoboron compound with organosilicon compound SHOWA DENKO K.K. (JP) 1995-12-19 US disclosed
EP-0578473-A1 Catalyst for polymerization of olefin and process for producing olefin polymer SHOWA DENKO KABUSHIKI KAISHA (JP) 1994-01-12 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170015659-A1 Prodrugs of NH-Acidic Compounds SI, NAAA, NIT2 TDP1 3433/4885TSHR 3738/4885SMN1; SMN2 606/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.