SCHEMBL6696083

SCHEMBL6696083

C=C(Cc1ccccc1)C(=O)OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.61
MAPK1 P28482 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
TDP1 Q9NUW8 2/20 0.52
SLC6A2 P23975 1/20 0.52
SLC6A3 Q01959 1/20 0.52
KMT2A Q03164 1/20 0.52
LMNA P02545 3/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HCAR2 Q8TDS4 1/20 0.47
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
AKR1B1 P15121 1/20 0.47
PAM P19021 1/20 0.46
HTT P42858 1/20 0.45
FNTA P49354 1/20 0.44
FNTB P49356 1/20 0.44

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
Acrylic Acid SCHEMBL28230352 0.92 ALDH1A1 (0.53) ALDH1A1MAPK1L3MBTL1TDP1SLC6A2
SCHEMBL1764151 0.92 ALDH1A1 (0.53) ALDH1A1MAPK1L3MBTL1TDP1SLC6A2
SCHEMBL1764063 0.91 ALDH1A1 (0.51) ALDH1A1MAPK1L3MBTL1TDP1SLC6A2
SCHEMBL824071 0.85 ALDH1A1 (0.53) ALDH1A1MAPK1L3MBTL1TDP1SLC6A2
SCHEMBL26128842 0.85 ALDH1A1 (0.53) ALDH1A1MAPK1L3MBTL1TDP1SLC6A2
SCHEMBL1520510 0.84 ALDH1A1 (0.52) ALDH1A1MAPK1L3MBTL1TDP1SLC6A2
SCHEMBL672369 0.84 ALDH1A1 (0.52) ALDH1A1MAPK1L3MBTL1TDP1SLC6A2
SCHEMBL7919473 0.84 ALDH1A1 (0.52) ALDH1A1MAPK1L3MBTL1TDP1SLC6A2
SCHEMBL1812517 0.84 ALDH1A1 (0.56) ALDH1A1MAPK1L3MBTL1TDP1SLC6A2
SCHEMBL528358 0.84 ALDH1A1 (0.52) ALDH1A1MAPK1L3MBTL1TDP1SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116981758-A Thermally responsive brush polymers having a copolymer backbone and copolymer arms 英菲诺姆国际有限公司 2023-10-31 CN disclosed
CN-112876376-B Synthesis method of allyl aryl compound 山东领海生物科技有限公司 2022-11-01 CN disclosed
CN-112876376-A Synthesis method of allyl aryl compound 山东领海生物科技有限公司 2021-06-01 CN disclosed
EP-3056542-B1 (METH)ACRYLIC COPOLYMER, RESIN COMPOSITION, AND MOLDED PRODUCT OF SAID RESIN COMPOSITION MITSUBISHI GAS CHEMICAL CO (JP) 2018-11-28 EP disclosed
EP-3056542-A1 (METH)ACRYLIC COPOLYMER, RESIN COMPOSITION, AND MOLDED PRODUCT OF SAID RESIN COMPOSITION Mitsubishi Gas Chemical Company, Inc. (JP) 2016-08-17 EP disclosed
CN-105008469-A Latex emulsions and coating compositions prepared from latex emulsions AKZO NOBEL COATINGS INT BV 2015-10-28 CN disclosed
WO-2012069856-A1 ANTIMALARIAL COMPOUNDS LIVERPOOL SCHOOL OF TROPICAL MEDICINE (GB) 2012-05-31 WO disclosed
CN-1296053-C Use of non-digestible polymeric foams to sequester ingested materials thereby inhibiting their absorption by body PROCTER & GAMBLE (US) 2007-01-24 CN disclosed
US-20040192780-A1 Alkylaminoalkyl-terminated sulfide/sulfonyl-containing propargyl amino-diol compounds for treatment of hypertension G.D. SEARLE & CO. 2004-09-30 US disclosed
CN-1531437-A Use of non-digestible polymeric foams to sequester ingested materials thereby inhibiting their absorption by body 2004-09-22 CN disclosed
WO-1993025574-A1 INHIBITORS OF ANGIOTENSIN I CHYMASE(S) INCLUDING HUMAN HEART CHYMASE PFIZER INC. (US) 1993-12-23 WO disclosed
EP-0572909-A1 Amino acid derivatives as renin inhibitors F. HOFFMANN-LA ROCHE AG (CH) 1993-12-08 EP disclosed
US-5258362-A Enzyme inhibitors, amides with oxetane ring ABBOTT LABORATORIES (US) 1993-11-02 US disclosed
WO-1992022313-A1 RENIN INHIBITING COMPOUNDS ABBOTT LABORATORIES (US) 1992-12-23 WO disclosed
EP-0509354-A2 Amino acid derivatives F. HOFFMANN-LA ROCHE AG (CH) 1992-10-21 EP disclosed
US-5142056-A Human immunodeficiency virus protease inhibitor ABBOTT LABORATORIES (US) 1992-08-25 US disclosed
EP-0402646-A1 Retroviral protease inhibiting compounds ABBOTT LABORATORIES (US) 1990-12-19 EP disclosed
WO-1990002144-A1 COMPOSITIONS FOR MAKING IMPROVED GAS PERMEABLE CONTACT LENSES FUSED KONTACTS OF CHICAGO, INC. (US) 1990-03-08 WO disclosed
EP-0117429-B1 PHOSPHOROUS CONTAINING COMPOUNDS AS INHIBITORS OF ENKEPHALINASES SCHERING CORPORATION (US) 1987-09-02 EP disclosed
EP-0117429-A1 Phosphorous containing compounds as inhibitors of enkephalinases SCHERING CORPORATION (US) 1984-09-05 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-20040192780-A1 Alkylaminoalkyl-terminated sulfide/sulfonyl-containing propargyl amino-diol compounds for treatment of hypertension REN, AGTR1, AGTR2 ALDH1A1 720/4885MAPK1 1156/4885L3MBTL1 2447/4885

“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.