SCHEMBL112347

SCHEMBL112347

C=CCC(=O)C(=O)OC1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.41
CYP2C19 P33261 1/20 0.39
NAAA Q02083 2/20 0.38
HTT P42858 1/20 0.37
CYP19A1 P11511 2/20 0.35
GPR35 Q9HC97 2/20 0.35
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA9 Q16790 2/20 0.34
ALDH1A1 P00352 2/20 0.32
GAA P10253 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MMP1 P03956 1/20 0.31
MMP9 P14780 1/20 0.31
MMP12 P39900 1/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL1593817 0.81 CYP2C19 (0.49) EPHX1CYP2C19NAAAHTTCYP19A1
SCHEMBL17470137 0.81 CYP2C19 (0.49) EPHX1CYP2C19NAAAHTTCYP19A1
SCHEMBL1785210 0.80 EPHX1 (0.40) EPHX1CYP2C19NAAAHTTCYP19A1
SCHEMBL2999385 0.75 EPHX1 (0.54) EPHX1CYP2C19NAAAHTTCYP19A1
SCHEMBL18186686 0.75 EPHX1 (0.53) EPHX1CYP2C19NAAAHTTCYP19A1
SCHEMBL3927732 0.75 EPHX1 (0.53) EPHX1CYP2C19NAAAHTTCYP19A1
SCHEMBL1785208 0.74 NAAA (0.38) EPHX1CYP2C19NAAAHTTCYP19A1
SCHEMBL4542072 0.74 EPHX1 (0.41) EPHX1CYP2C19NAAAHTTCYP19A1
SCHEMBL11591531 0.72 EPHX1 (0.50) EPHX1CYP2C19NAAAHTTCYP19A1
SCHEMBL3020222 0.72 NAAA (0.54) EPHX1CYP2C19NAAAHTTCYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210329915-A1 ABSORPTION PROMOTER, FLYING-INSECT PEST REPELLENT FRAGRANCE-CONTAINING COMPOSITION, AND FLYING-INSECT PEST REPELLENT PRODUCT DAINIHON JOCHUGIKU CO., LTD. (JP) 2021-10-28 US claimed
WO-2019198608-A1 FLYING-NOXIOUS-INSECT-REPELLENT PRODUCT AND METHOD FOR REPELLING FLYING NOXIOUS INSECTS 大日本除蟲菊株式会社 2019-10-17 WO claimed
EP-2174645-B1 Materials containing aromas incorporating cetyl nonanoate and/or stearyl nonanoate SYMRISE AG (DE) 2015-07-29 EP claimed
US-12004630-B2 System for dispensing a cosmetic product L'OREAL (FR) 2024-06-11 US disclosed
US-11998104-B2 System for dispensing a cosmetic product L'OREAL (FR) 2024-06-04 US disclosed
US-11980277-B2 System for dispensing a cosmetic product L'OREAL (FR) 2024-05-14 US disclosed
US-11974651-B2 System for dispensing a cosmetic product L'OREAL (FR) 2024-05-07 US disclosed
US-20240123714-A1 CONSUMER PRODUCT CONOPCO, INC., D/B/A UNILEVER 2024-04-18 US disclosed
US-11946026-B2 Fabric care composition and method for improving fragrance intensity with isopropyl myristate INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2024-04-02 US disclosed
EP-4294637-A1 CONSUMER PRODUCT Unilever IP Holdings B.V. (NL) 2023-12-27 EP disclosed
US-20230287299-A1 IRRITATION MITIGATING SURFACTANTS CONOPCO, INC., D/B/A UNILEVER (US) 2023-09-14 US disclosed
EP-1417372-A1 FRAGRANCE COMPOSITIONS FOR CO2 DRY CLEANING PROCESS Symrise GmbH & Co. KG (DE) 2004-05-12 EP disclosed
US-20040048771-A1 Encapsulated perfume compositions in hair and skin products which release a burst of fragrance after initial topical application SYMRISE, INC. 2004-03-11 US disclosed
US-20040001891-A1 Controlled release encapsulation SYMRISE AG (DE) 2004-01-01 US disclosed
US-20030199412-A1 Fragrance containing cleaning product HAARMANN & REIMER 2003-10-23 US disclosed
US-20030087774-A1 Fragrance compositions for the CO2 washing process SYMRISE GMBH & CO. KG (DE) 2003-05-08 US disclosed
US-20030068295-A1 Odor neutralizers SYMRISE AG (DE) 2003-04-10 US disclosed
WO-2003010381-A1 FRAGRANCE COMPOSITIONS FOR CO2 DRY CLEANING PROCESS SYMRISE GMBH & CO. KG (DE) 2003-02-06 WO disclosed
EP-1239890-A2 ODOR NEUTRALIZERS HAARMANN & REIMER GMBH (DE) 2002-09-18 EP disclosed
WO-2001043784-A2 ODOR NEUTRALIZERS HAARMANN & REIMER GMBH (DE) 2001-06-21 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 (5 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-20030068295-A1 Odor neutralizers OXER1, OR51E2, OR10J3 EPHX1 701/4885CYP2C19 1843/4885NAAA 1469/4885
US-11980277-B2 System for dispensing a cosmetic product PDE12, SAMM50, POLR1C EPHX1 876/4885CYP2C19 3565/4885NAAA 1817/4885
US-11974651-B2 System for dispensing a cosmetic product PDE12, SAMM50, POLR1C EPHX1 876/4885CYP2C19 3565/4885NAAA 1817/4885
US-11998104-B2 System for dispensing a cosmetic product PDE12, SAMM50, POLR1C EPHX1 876/4885CYP2C19 3565/4885NAAA 1817/4885
US-12004630-B2 System for dispensing a cosmetic product PDE12, SAMM50, POLR1C EPHX1 876/4885CYP2C19 3565/4885NAAA 1817/4885

“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.