SCHEMBL873056

SCHEMBL873056

CC(=O)OC(=O)c1ccc(C(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.47
PRSS1 P07477 1/20 0.46
ACR P10323 1/20 0.46
USP5 P45974 1/20 0.46
POLB P06746 2/20 0.45
HTT P42858 1/20 0.44
ALDH1A1 P00352 4/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
LMNA P02545 1/20 0.43
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
RAB9A P51151 4/20 0.41

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
SCHEMBL9699988 0.90 CYP2C9 (0.52) CYP2C9PRSS1ACRUSP5POLB
SCHEMBL123279 0.85 TSHR (0.47) ALDH1A1MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL9699992 0.82 TSHR (0.50) CYP2C9PRSS1ACRUSP5POLB
SCHEMBL18907770 0.82 ALDH1A1 (0.49) CYP2C9ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL23404253 0.81 CYP2C9 (0.52) CYP2C9PRSS1ACRUSP5POLB
SCHEMBL16174749 0.81 USP5 (0.47) CYP2C9PRSS1ACRUSP5POLB
SCHEMBL84424 0.79 CA1 (0.59) CYP2C9ALDH1A1MEN1KMT2ACA12
SCHEMBL9350953 0.79 CYP2C9 (0.50) CYP2C9PRSS1ACRUSP5POLB
SCHEMBL6444130 0.79 ALDH1A1 (0.52) HTTALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL4493359 0.79 MAPT (0.54) POLBALDH1A1KMT2ASMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023069548-A1 MALODOR-COUNTERACTING COMPOUNDS, COMPOSITIONS, AND USES THEREOF INTERNATIONAL FLAVORS AND FRAGRANCES INC. (US) 2023-04-27 WO claimed
WO-2002098966-A2 AROMATIC PRINCIPLES FOR IMPROVING THE STABILITY IN STORAGE AND/OR FOR IMPROVING THE SOLUBILITY OF POLYVINYL ALCOHOLS AND/OR POLYVINYL ALCOHOLS WITH BONDED CELLULOSE DROM FRAGRANCES INTERNATIONAL KG (DE) 2002-12-12 WO claimed
US-20260033524-A1 FLAVOR MODIFYING COMPOSITIONS CORN PRODUCTS DEV INC (US) 2026-02-05 US disclosed
EP-4561366-A1 FLAVOR MODIFYING COMPOSITION CORN Products Development Inc. (US) 2025-06-04 EP disclosed
US-20250081996-A1 FLAVOR MODIFYING COMPOSITION PURECIRCLE SDN BHD (MY) 2025-03-13 US disclosed
EP-4380375-A1 METHODS FOR THERMALLY INHIBITING STARCH CORN Products Development Inc. (US) 2024-06-12 EP disclosed
WO-2024026450-A1 FLAVOR MODIFYING COMPOSITION CORN PRODUCTS DEVELOPMENT, INC. (US) 2024-02-01 WO disclosed
WO-2023069548-A1 MALODOR-COUNTERACTING COMPOUNDS, COMPOSITIONS, AND USES THEREOF INTERNATIONAL FLAVORS AND FRAGRANCES INC. (US) 2023-04-27 WO disclosed
WO-2023014926-A1 FLAVOR MODIFYING COMPOSITION CORN PRODUCTS DEVELOPMENT, INC. (US) 2023-02-09 WO disclosed
EP-3554275-A1 MODIFYING OR ENHANCING A FLAVOR OF FOOD AND BEVERAGE PRODUCTS Tate & Lyle Ingredients Americas LLC (US) 2019-10-23 EP disclosed
US-20190313680-A1 MODIFYING OR ENHANCING A FLAVOR OF FOOD AND BEVERAGE PRODUCTS TATE & LYLE INGREDIENTS AMERICAS LLC (US) 2019-10-17 US disclosed
EP-1707185-A1 Solvent materials and methods for preparing fragrance compositions INTERNATIONAL FLAVORS & FRAGRANCES, INC. (US) 2006-10-04 EP disclosed
US-20060165622-A1 Deodorant composition TAKASAGO INTERNATIONAL CORPORATION (JP) 2006-07-27 US disclosed
WO-2006068276-A1 HAIR PROCESSING AGENT AND METHOD FOR PERMANENT WAVING HAIR SHOWA DENKO K.K. (JP) 2006-06-29 WO disclosed
US-20050245407-A1 Fragrance composition KAO CORPORATION (JP) 2005-11-03 US disclosed
CN-1674862-A Perfume composition KAO CORP (JP) 2005-09-28 CN disclosed
EP-1561476-A1 DEODORANT COMPOSITION Takasago International Corporation (JP) 2005-08-10 EP disclosed
EP-1552814-A1 FRAGRANCE COMPOSITION Kao Corporation (JP) 2005-07-13 EP disclosed
US-6844302-B1 Encapsulated flavor and fragrance INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2005-01-18 US disclosed
WO-2002098966-A2 AROMATIC PRINCIPLES FOR IMPROVING THE STABILITY IN STORAGE AND/OR FOR IMPROVING THE SOLUBILITY OF POLYVINYL ALCOHOLS AND/OR POLYVINYL ALCOHOLS WITH BONDED CELLULOSE DROM FRAGRANCES INTERNATIONAL KG (DE) 2002-12-12 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 (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-20260033524-A1 FLAVOR MODIFYING COMPOSITIONS TAS2R42, TAS2R7, TAS2R31 CYP2C9 1554/4885PRSS1 3995/4885ACR 280/4885

“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.