SCHEMBL571114

SCHEMBL571114

O=[C]CC(=O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.58
KMT2A Q03164 3/20 0.58
CES1 P23141 3/20 0.58
MAPK1 P28482 2/20 0.58
MAPT P10636 2/20 0.58
MEN1 O00255 2/20 0.58
CYP3A4 P08684 2/20 0.58
HPGD P15428 2/20 0.58
KDM4E B2RXH2 2/20 0.58
ALOX15 P16050 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
ALDH1A1 P00352 5/20 0.54
GSK3B P49841 2/20 0.54
PTPN1 P18031 2/20 0.54
HIF1A Q16665 2/20 0.54
TRPA1 O75762 1/20 0.54
L3MBTL1 Q9Y468 2/20 0.52
LMNA P02545 1/20 0.52
NR4A2 P43354 1/20 0.52
ERCC5 P28715 1/20 0.50

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
SCHEMBL7085528 0.81 MAPK1 (0.58) TDP1KMT2ACES1MAPK1MAPT
Benzene SCHEMBL28690163 0.81 MAPK1 (0.58) TDP1KMT2ACES1MAPK1MAPT
SCHEMBL4621332 0.79 MAPT (0.56) TDP1KMT2ACES1MAPK1MAPT
SCHEMBL22313390 0.79 CES1 (0.56) TDP1KMT2ACES1MAPK1MAPT
SCHEMBL8629047 0.79 KMT2A (0.56) TDP1KMT2ACES1MAPK1MAPT
SCHEMBL136826 0.79 CES1 (0.56) TDP1KMT2ACES1MAPK1MAPT
SCHEMBL29092014 0.79 KMT2A (0.56) TDP1KMT2ACES1MAPK1MAPT
SCHEMBL11332901 0.77 CES1 (0.54) TDP1KMT2ACES1MAPK1MAPT
SCHEMBL276675 0.77 TDP1 (0.59) TDP1KMT2ACES1MAPK1MAPT
SCHEMBL6752860 0.77 CES1 (0.54) TDP1KMT2ACES1MAPK1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3063228-B1 DISPERSE DYES, THEIR PREPARATION AND THEIR USE DYSTAR COLOURS DISTRIB GMBH (DE) 2020-04-01 EP claimed
CN-104604551-B A kind of preparation method of temperature induced color changing preserved flower 宁波远鸿生物科技有限公司 2018-04-13 CN claimed
CN-107778532-A A kind of ferrocenyl hydrophobically modified carbon black and preparation method thereof 安徽龙川橡塑科技有限公司 2018-03-09 CN claimed
US-9567464-B2 Disperse dyes, their preparation and their use DYSTAR COLOURS DISTRIBUTION GMBH (DE) 2017-02-14 US claimed
US-20160280922-A1 DISPERSE DYES, THEIR PREPARATION AND THEIR USE DYSTAR COLOURS DISTRIBUTION GMBH (DE) 2016-09-29 US claimed
EP-3063228-A2 DISPERSE DYES, THEIR PREPARATION AND THEIR USE DyStar Colours Distribution GmbH (DE) 2016-09-07 EP claimed
CN-105683295-A Disperse dyes, their preparation and their use 德司达染料分销有限公司 2016-06-15 CN claimed
WO-2015062937-A2 DISPERSE DYES, THEIR PREPARATION AND THEIR USE DYSTAR COLOURS DISTRIBUTION GMBH (DE) 2015-05-07 WO claimed
EP-2868702-A1 Disperse dyes, their preparation and their use DyStar Colours Distribution GmbH (DE) 2015-05-06 EP claimed
CN-103748123-A Method for manufacturing fluoroelastomers SOLVAY SPECIALTY POLYMERS IT 2014-04-23 CN claimed
WO-2005051336-A1 METHOD FOR DYEING FIBRES CONTAINING KERATINE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2005-06-09 WO claimed
EP-1534227-A1 AGENTS USED FOR DYEING KERATINOUS FIBERS Henkel Kommanditgesellschaft auf Aktien (DE) 2005-06-01 EP claimed
WO-2004058203-A2 AGENT FOR DYEING FIBRES CONTAINING KERATIN HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (US) 2004-07-15 WO claimed
WO-2004022016-A1 AGENTS USED FOR DYEING KERATINOUS FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2004-03-18 WO claimed
EP-1017673-A1 SPECIFIC IMMUNOPHILIN LIGANDS USEFUL AS ANTI-ASTHMATIC, ANTI-ALLERGIC, ANTI-RHEUMATIC, IMMUNOSUPPRESSIVE, ANTIPSORIATIC AND NEUROPROTECTIVE AGENTS ASTA Medica Aktiengesellschaft (DE) 2000-07-12 EP claimed
WO-1999015501-A1 SPECIFIC IMMUNOPHILIN LIGANDS USEFUL AS ANTI-ASTHMATIC, ANTI-ALLERGIC, ANTI-RHEUMATIC, IMMUNOSUPPRESSIVE, ANTIPSORIATIC AND NEUROPROTECTIVE AGENTS ASTA MEDICA AKTIENGESELLSCHAFT (DE) 1999-04-01 WO claimed
EP-0896580-A1 SPECIFIC IMMUNOPHILIN LIGANDS AS ANTIASTHMATICS AND IMMUNOSUPPRESSANTS ASTA Medica Aktiengesellschaft (DE) 1999-02-17 EP claimed
WO-1997041148-A1 SPECIFIC IMMUNOPHILIN LIGANDS AS ANTIASTHMATICS AND IMMUNOSUPPRESSANTS ASTA MEDICA AKTIENGESELLSCHAFT (DE) 1997-11-06 WO claimed
EP-0254179-A2 Tetrahydrobenzothiazoloquinolines, their preparation and use BOEHRINGER INGELHEIM KG (DE) 1988-01-27 EP claimed
EP-0059146-B1 MEDICAMENTS DERIVED FROM 3-HYDROXY DODECAHYDRO BENZ(E) INDEN-7-ON, PRODUCTS DERIVED FROM 3-HYDROXY DODECAHYDRO BENZ(E) INDEN-7-ON AND PROCESS FOR THEIR PREPARATION ROUSSEL-UCLAF (FR) 1985-09-25 EP claimed

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-20160280922-A1 DISPERSE DYES, THEIR PREPARATION AND THEIR USE IK, NDUFS7, CYP1B1 TDP1 449/4885KMT2A 2760/4885CES1 539/4885

“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.