SCHEMBL2267201

SCHEMBL2267201

CC(C)CCOC(=O)CC(=O)OCCC(C)C

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.50
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
GAA P10253 2/20 0.46
MGAM O43451 1/20 0.46
SI P14410 1/20 0.46
MGAM2 Q2M2H8 1/20 0.46
TDP1 Q9NUW8 2/20 0.44
MAPK1 P28482 2/20 0.43
PKM P14618 2/20 0.43
HSD17B10 Q99714 1/20 0.43
EPHX2 P34913 1/20 0.43
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
KMT2A Q03164 1/20 0.41
CHRNB2 P17787 4/20 0.39
CHRNA4 P43681 4/20 0.39
ACHE P22303 1/20 0.39

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
Butane SCHEMBL6048873 0.93 GAA (0.46) CYP19A1CA12CA1CA2CA9
SCHEMBL28099367 0.91 CYP19A1 (0.47) CYP19A1CA12CA1CA2CA9
SCHEMBL17847707 0.89 GAA (0.46) CYP19A1CA12CA1CA2CA9
SCHEMBL1171910 0.89 GAA (0.46) CYP19A1CA12CA1CA2CA9
SCHEMBL6635716 0.89 CYP19A1 (0.46) CYP19A1CA12CA1CA2CA9
Ethane SCHEMBL5391797 0.87 CYP19A1 (0.45) CYP19A1CA12CA1CA2CA9
SCHEMBL27809021 0.86 MGAM (0.42) CYP19A1CA1GAAMGAMSI
SCHEMBL333015 0.85 ADRA2A (0.50) CYP19A1CA12CA1CA2CA9
SCHEMBL4487328 0.85 PKM (0.41) CYP19A1CA12CA1CA2CA9
SCHEMBL28927929 0.84 TDP1 (0.68) CYP19A1CA12CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1798538-A Photostable organic sunscreen composition MERCK PATENT GMBH (DE) 2006-07-05 CN claimed
US-12410277-B2 Block polyisocyanate composition, resin composition, resin film and layered body ASAHI KASEI KABUSHIKI KAISHA (JP) 2025-09-09 US disclosed
US-20240287243-A1 BLOCKED POLYISOCYANATE COMPOSITION, RESIN COMPOSITION, RESIN FILM AND LAMINATE ASAHI KASEI KABUSHIKI KAISHA (JP) 2024-08-29 US disclosed
CN-114716591-B Catalyst component for propylene polymerization, preparation method and application thereof 任丘市利和科技发展有限公司 2024-05-28 CN disclosed
EP-4365252-A2 BLOCK POLYISOCYANATE COMPOSITION, RESIN COMPOSITION, RESIN FILM, AND LAYERED BODY Asahi Kasei Kabushiki Kaisha (JP) 2024-05-08 EP disclosed
EP-4364944-A1 BLOCK POLYISOCYANATE COMPOSITION, RESIN COMPOSITION, RESIN FILM, AND LAYERED BODY Asahi Kasei Kabushiki Kaisha (JP) 2024-05-08 EP disclosed
EP-3771720-B1 BLOCKED POLYISOCYANATE COMPOSITION, RESIN COMPOSITION, RESIN FILM AND LAMINATE ASAHI CHEMICAL IND (JP) 2024-05-01 EP disclosed
WO-2024063100-A1 METHOD FOR PRODUCING POLYVALENT CARBODIIMIDE B 旭化成株式会社 2024-03-28 WO disclosed
EP-3689936-B1 BLOCKED POLYISOCYANATE COMPOSITION AND USE THEREOF ASAHI CHEMICAL IND (JP) 2024-03-06 EP disclosed
EP-4332137-A1 BASE COATING COMPOSITION, MULTILAYER COATING FILM LAMINATE, AND METHOD FOR FORMING MULTILAYER COATING FILM LAMINATE Asahi Kasei Kabushiki Kaisha (JP) 2024-03-06 EP disclosed
EP-1635777-A1 PHOTOSTABLE ORGANIC SUNSCREEN COMPOSITION MERCK PATENT GmbH (DE) 2006-03-22 EP disclosed
US-6831191-B2 Blocking ultraviolet radiation on skin EM INDUSTRIES 2004-12-14 US disclosed
WO-2004105712-A1 PHOTOSTABLE ORGANIC SUNSCREEN COMPOSITION MERCK PATENT GMBH (DE) 2004-12-09 WO disclosed
US-20040247536-A1 Photo stable organic sunscreen compositions EMD CHEMICALS, INC. 2004-12-09 US disclosed
WO-2004076425-A1 IMPROVED SYNTHESIS OF MACROCYCLIC TETRAAMIDO COMPOUNDS AND NEW METAL INSERTION PROCESS CARNEGIE MELLON UNIVERSITY (US) 2004-09-10 WO disclosed
EP-1406582-A1 PHOTOSTABLE ORGANIC SUNSCREEN COMPOUNDS WITH ANTIOXIDANT PROPERTIES AND COMPOSITIONS OBTAINED THEREFROM MERCK PATENT GmbH (DE) 2004-04-14 EP disclosed
US-20030157035-A1 PHOTO STABLE ORGANIC SUNSCREEN COMPOUNDS WITH ANTIOXIDANT PROPERTIES AND COMPOSITIONS OBTAINED THEREFROM EM INDUSTRIES 2003-08-21 US disclosed
US-6602515-B2 Alpha-acetyl-3,5-dimethoxy-4-hydroxy cinnamate ester; dipalmitoyl-3,5- dimethoxy-4-hydroxy benzylidene malonate or amide derivatives EM INDUSTRIES 2003-08-05 US disclosed
US-20030108492-A1 PHOTO STABLE ORGANIC SUNSCREEN COMPOUNDS WITH ANTIOXIDANT PROPERTIES AND COMPOSITIONS OBTAINED THEREFROM EM INDUSTRIES 2003-06-12 US disclosed
WO-2003007906-A1 PHOTOSTABLE ORGANIC SUNSCREEN COMPOUNDS WITH ANTIOXIDANT PROPERTIES AND COMPOSITIONS OBTAINED THEREFROM MERCK PATENT GMBH (DE) 2003-01-30 WO 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 (3 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-20030157035-A1 PHOTO STABLE ORGANIC SUNSCREEN COMPOUNDS WITH ANTIOXIDANT PROPERTIES AND COMPOSITIONS OBTAINED THEREFROM ERCC1, ERCC4, OGG1 CYP19A1 439/4885CA12 3190/4885CA1 4060/4885
US-20030108492-A1 PHOTO STABLE ORGANIC SUNSCREEN COMPOUNDS WITH ANTIOXIDANT PROPERTIES AND COMPOSITIONS OBTAINED THEREFROM ERCC1, ERCC4, OGG1 CYP19A1 285/4885CA12 3087/4885CA1 4075/4885
US-20040247536-A1 Photo stable organic sunscreen compositions SUN2, CCNB1, TYR CYP19A1 116/4885CA12 4608/4885CA1 4800/4885

“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.