SCHEMBL3628816

SCHEMBL3628816

COCC(=O)Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.52
CES2 O00748 1/20 0.52
AKR1B1 P15121 1/20 0.52
PAM P19021 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.49
TDP1 Q9NUW8 1/20 0.49
TSHR P16473 2/20 0.48
ALDH1A1 P00352 5/20 0.47
MAPK1 P28482 1/20 0.47
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
RAB9A P51151 2/20 0.45
MAPT P10636 1/20 0.45
NPC1 O15118 1/20 0.44
FNTA P49354 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
SCHEMBL7563153 0.86 SRD5A2 (0.55) ALDH1A1SMN1; SMN2
SCHEMBL9571882 0.85 ALOX5 (0.62) L3MBTL1ALDH1A1LMNAHDAC6SMN1; SMN2
SCHEMBL9571873 0.82 CA2 (0.52) ALDH1A1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL4479767 0.80 ALOX5 (0.57) L3MBTL1TDP1ALDH1A1KDM4ELMNA
SCHEMBL8867104 0.80 HTT (0.59) L3MBTL1ALDH1A1KDM4ELMNAKMT2A
SCHEMBL29116748 0.80 ALDH1A1 (0.56) CES1CES2AKR1B1PAML3MBTL1
SCHEMBL2254547 0.80 ALDH1A1 (0.60) CES1CES2AKR1B1PAML3MBTL1
Methyl Alcohol SCHEMBL11054071 0.80 CES1 (0.64) CES1CES2AKR1B1PAML3MBTL1
SCHEMBL77563 0.79 CES1 (0.70) CES1CES2AKR1B1PAML3MBTL1
SCHEMBL8699812 0.79 CES2 (0.47) CES1CES2AKR1B1PAML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118026102-A Photochemical synthesis method for preparing solid hydrogen peroxide compound 四川大学 2024-05-14 CN claimed
EP-4688717-A1 PALLADIUM-CATALYZED CHEMOSELECTIVE MONO-ALPHA-ARYLATION OF O-PROTECTED HYDROXYACETONE Bayer Aktiengesellschaft (DE) 2026-02-11 EP disclosed
WO-2024200462-A1 PALLADIUM-CATALYZED CHEMOSELECTIVE MONO-α-ARYLATION OF O-PROTECTED HYDROXYACETONE BAYER AKTIENGESELLSCHAFT (DE) 2024-10-03 WO disclosed
CN-118026102-A Photochemical synthesis method for preparing solid hydrogen peroxide compound 四川大学 2024-05-14 CN disclosed
CN-113185386-B Rapid synthesis method of biomass-based olefin 贵州大学 2023-05-30 CN disclosed
US-20210289794-A1 COMPOSITIONS AND RELATED METHODS FOR AGRICULTURE FLAGSHIP PIONEERING INNOVATIONS V, INC. 2021-09-23 US disclosed
CN-111662167-A Method for isomerizing cis-anethole by catalyst 贵州柏森香料有限公司 2020-09-15 CN disclosed
US-20190002846-A1 POLYPEPTIDES HAVING DEMETHYLATING ACTIVITY GENENCOR INTERNATIONAL B.V. (NL) 2019-01-03 US disclosed
EP-3313999-A2 POLYPEPTIDES HAVING DEMETHYLATING ACTIVITY Genencor International B.V. (NL) 2018-05-02 EP disclosed
US-9959392-B2 Olfactory signature and odorant mixture having the same YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2018-05-01 US disclosed
US-6835853-B2 Purification of racemic mixtures SYNTHON BV (NL) 2004-12-28 US disclosed
EP-1444198-A1 PROCESS FOR RESOLUTION OF TAMSULOSIN Synthon B.V. (NL) 2004-08-11 EP disclosed
EP-1444199-A1 RACEMIC TAMSULOSIN FREE BASE AND METHODS OF MAKING THE SAME Synthon B.V. (NL) 2004-08-11 EP disclosed
US-6599917-B1 A squalene-synthesizing enzyme inhibitor, a cholesterol biosynthesis inhibitor and a triglyceride biosynthesis inhibitor EISAI CO., LTD. (JP) 2003-07-29 US disclosed
US-20030109752-A1 Process for resolution of tamsulosin and compounds, compositons, and processes associated therewith SYNTHON IP INC. 2003-06-12 US disclosed
WO-2003037851-A1 RACEMIC TAMSULOSIN FREE BASE AND METHODS OF MAKING THE SAME SYNTHON B.V. (NL) 2003-05-08 WO disclosed
WO-2003037850-A1 PROCESS FOR RESOLUTION OF TAMSULOSIN SYNTHON B.V. (NL) 2003-05-08 WO disclosed
EP-1217001-A1 QUINUCLIDINE COMPOUNDS AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT Eisai Co., Ltd. (JP) 2002-06-26 EP disclosed
US-4980268-A POLYAMIC ACID CONVERTIBLE TO POLYIMIDES CIBA-GEIGY CORPORATION (US) 1990-12-25 US disclosed
EP-0094256-B1 BIOLOGICAL PROCESS FOR PRODUCING ACID PRECIPITABLE POLYMERIC LIGNIN CHEMGEN CORPORATION (US) 1989-08-09 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-20030109752-A1 Process for resolution of tamsulosin and compounds, compositons, and processes associated therewith NPSR1, REN, PTMA CES1 639/4885CES2 2411/4885AKR1B1 118/4885

“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.