SCHEMBL1473218

SCHEMBL1473218

C/C=C(\C)C(=O)OCC(C)C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.59
ALDH1A1 P00352 4/20 0.39
HPGD P15428 1/20 0.35
TDP1 Q9NUW8 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PPARG P37231 1/20 0.33
NCOA2 Q15596 1/20 0.33
NCOA1 Q15788 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
NCOA3 Q9Y6Q9 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
ALOX15 P16050 1/20 0.32
MAP3K7 O43318 1/20 0.32
TAB1 Q15750 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL873046 1.00 TSHR (0.59) TSHRALDH1A1HPGDTDP1SMN1; SMN2
SCHEMBL873047 1.00 TSHR (0.59) TSHRALDH1A1HPGDTDP1SMN1; SMN2
Glycine SCHEMBL28248698 0.89 TSHR (0.48) TSHRALDH1A1HPGDMAP3K7TAB1
SCHEMBL10799068 0.87 TSHR (0.47) TSHRALDH1A1HPGDSMN1; SMN2CYP2D6
SCHEMBL28250022 0.86 ALOX15 (0.46) TSHRALDH1A1HPGDTDP1SMN1; SMN2
SCHEMBL7932628 0.85 TSHR (0.44) TSHRSMN1; SMN2MAPTDHCR24
SCHEMBL7932630 0.85 TSHR (0.44) TSHRSMN1; SMN2MAPTDHCR24
SCHEMBL6062547 0.84 TSHR (0.57) TSHRALDH1A1HPGDTDP1SMN1; SMN2
SCHEMBL4219082 0.84 TSHR (0.42) TSHRMAPTCYP2D6CYP2C19DHCR24
SCHEMBL8853633 0.84 TSHR (0.42) TSHRMAPTCYP2D6CYP2C19DHCR24

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4405471-A1 GENETICALLY IMPROVED MICROORGANISM STRAIN CAPABLE OF PRODUCING LARGER AMOUNTS OF VOLATILE ORGANIC COMPOUNDS OF INTEREST, AND SCREENING METHOD FOR OBTAINING SUCH STRAINS Université de La Réunion (FR) 2024-07-31 EP claimed
WO-2023047070-A1 GENETICALLY IMPROVED MICROORGANISM STRAIN CAPABLE OF PRODUCING LARGER AMOUNTS OF VOLATILE ORGANIC COMPOUNDS OF INTEREST, AND SCREENING METHOD FOR OBTAINING SUCH STRAINS UNIVERSITE DE LA REUNION (FR) 2023-03-30 WO claimed
WO-2018145219-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING AND TREATING ADDICTIONS BY MEANS OF AVERSIVE COUNTERCONDITIONING SERANI MOSTAZAL JORGE (CL) 2018-08-16 WO claimed
CN-122005375-A High-stability antiallergic collagen-chamomile active component hydrogel and large-scale preparation method and application thereof 自然资源部第三海洋研究所 2026-05-12 CN disclosed
EP-4405471-A1 GENETICALLY IMPROVED MICROORGANISM STRAIN CAPABLE OF PRODUCING LARGER AMOUNTS OF VOLATILE ORGANIC COMPOUNDS OF INTEREST, AND SCREENING METHOD FOR OBTAINING SUCH STRAINS Université de La Réunion (FR) 2024-07-31 EP disclosed
WO-2023047070-A1 GENETICALLY IMPROVED MICROORGANISM STRAIN CAPABLE OF PRODUCING LARGER AMOUNTS OF VOLATILE ORGANIC COMPOUNDS OF INTEREST, AND SCREENING METHOD FOR OBTAINING SUCH STRAINS UNIVERSITE DE LA REUNION (FR) 2023-03-30 WO disclosed
CN-110891615-B System and method for selecting and releasing fragrance 阿甘香气及精细化学有限公司 2022-08-05 CN disclosed
CN-113462581-B Fungus for producing fragrant substances 华南农业大学 2022-07-22 CN disclosed
US-20210164967-A1 OLFACTORY RECEPTOR INVOLVED IN THE PERCEPTION OF MUSK FRAGRANCE AND THE USE THEREOF CHEMOSENSORYX BIOSCIENCES SA (BE) 2021-06-03 US disclosed
EP-2648521-B1 INOCULANTS INCLUDING BACILLUS BACTERIA FOR INDUCING PRODUCTION OF VOLATILE ORGANIC COMPOUNDS IN PLANTS UNIV AUBURN (US) 2020-02-05 EP disclosed
US-20180273484-A1 DIAZIRINES AS PHOTOCAGES WHICH RELEASE MOLECULES CONTAINING DOUBLE BONDS HENKEL AG & CO. KGAA (DE) 2018-09-27 US disclosed
US-20040084162-A1 Low slough tissue products and method for making same KIMBERLY-CLARK WORLDWIDE, INC. 2004-05-06 US disclosed
EP-1341967-A2 SOFT TISSUE WITH IMPROVED LINT AND SLOUGH PROPERTIES Kimberly-Clark Worldwide, Inc. (US) 2003-09-10 EP disclosed
US-6488812-B2 USING AN ACRYLAMIDE TYPE COPOLYMER HAVING HYDROGEN BONDING CAPABILITY AND CONTAINING A HYDROPHOBIC ALIPHATIC HYDROCARBON MOIETY KIMBERLY-CLARK WORLDWIDE, INC. 2002-12-03 US disclosed
US-20020112834-A1 Soft tissue with improved lint and slough properties KIMBERLY-CLARK WORLDWIDE, INC. 2002-08-22 US disclosed
WO-2002048457-A2 SOFT TISSUE WITH IMPROVED LINT AND SLOUGH PROPERTIES KIMBERLY-CLARK WORLDWIDE, INC. (US) 2002-06-20 WO disclosed
EP-0170243-B1 FERMENTATION PROCESS FOR PREPARATION OF ALKYL ESTERS OF CARBOXYLIC ACIDS INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1992-03-18 EP disclosed
US-4686307-A Preparation of naturally-occurring C2 -C5 alkyl esters of C4 -C5 carboxylic acids by means of fermentation of C5 -C6 amino acids in the presence of C2 -C5 alcohols INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1987-08-11 US disclosed
US-4657862-A ORGANOLEPTIC UTILITIES INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1987-04-14 US disclosed
EP-0170243-A2 Fermentation process for preparation of alkyl esters of carboxylic acids INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1986-02-05 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-20180273484-A1 DIAZIRINES AS PHOTOCAGES WHICH RELEASE MOLECULES CONTAINING DOUBLE BONDS TRPA1, TRPC1, NISCH TSHR 3847/4885ALDH1A1 48/4885HPGD 363/4885

“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.