SCHEMBL3760910

SCHEMBL3760910

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nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
TP53 P04637 1/20 0.47
SLC7A5 Q01650 1/20 0.39
CYP2C9 P11712 1/20 0.39
PDE4A P27815 1/20 0.33
LMNA P02545 1/20 0.32
HIF1A Q16665 1/20 0.32
KDM4E B2RXH2 1/20 0.32
NFKB1 P19838 1/20 0.32
CYP2C19 P33261 1/20 0.32
FPR1 P21462 1/20 0.32
FPR2 P25090 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
SCHEMBL19359097 1.00 TSHR (0.50) TSHRTP53SLC7A5CYP2C9PDE4A
SCHEMBL28397725 1.00 TSHR (0.50) TSHRTP53SLC7A5CYP2C9PDE4A
SCHEMBL259033 1.00 TSHR (0.50) TSHRTP53SLC7A5CYP2C9PDE4A
SCHEMBL14748299 1.00 TSHR (0.50) TSHRTP53SLC7A5CYP2C9PDE4A
SCHEMBL19585105 1.00 TSHR (0.50) TSHRTP53SLC7A5CYP2C9PDE4A
SCHEMBL3137028 1.00 TSHR (0.50) TSHRTP53SLC7A5CYP2C9PDE4A
SCHEMBL2246998 0.83 TSHR (0.45) TSHRTP53SLC7A5CYP2C9PDE4A
SCHEMBL2251994 0.83 TSHR (0.45) TSHRTP53SLC7A5CYP2C9PDE4A
SCHEMBL25787135 0.83 TP53 (0.43) TSHRTP53SLC7A5CYP2C9FPR1
Butyric Acid SCHEMBL16972049 0.82 FFAR3 (0.52) TSHRPDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110632227-B Method for distinguishing Liuyang fermented soya beans, Yangjiang fermented soya beans and Yongchuan fermented soya beans 中南林业科技大学 2022-03-18 CN claimed
US-12606850-B2 Synthesis of beta-hydroxyisovalerate and methods of use Sasya, Inc. (US) 2026-04-21 US disclosed
US-12460234-B2 Synthesis of isoprenoids and derivatives WILLIAM MARSH RICE UNIVERSITY (US) 2025-11-04 US disclosed
US-12338481-B2 Method for producing 2-methyl-butyric acid by bacterial fermentation AJINOMOTO CO., INC. (JP) 2025-06-24 US disclosed
US-20250002949-A1 SYNTHESIS OF BETA-HYDROXYISOVALERATE AND METHODS OF USE Sasya Inc. 2025-01-02 US disclosed
US-20240376483-A1 RECOMBINANT MICROORGANISM AND L-LEUCINE PRODUCTION METHOD USING SAME GREEN EARTH INSTITUTE CO., LTD. (JP) 2024-11-14 US disclosed
US-20240182932-A1 SYNTHESIS OF ISOPRENOIDS AND DERIVATIVES WILLIAM MARSH RICE UNIVERSITY (US) 2024-06-06 US disclosed
EP-4034668-B1 METHOD FOR PRODUCING 2-METHYL-BUTYRIC ACID BY BACTERIAL FERMENTATION AJINOMOTO KK (JP) 2024-04-17 EP disclosed
US-11920177-B2 Synthesis of beta-hydroxyisovalerate and methods of use Sasya Inc. (US) 2024-03-05 US disclosed
EP-4320253-A1 SYNTHESIS OF BETA-HYDROXYISOVALERATE AND METHODS OF USE Sasya Inc. (US) 2024-02-14 EP disclosed
EP-4034668-A1 METHOD FOR PRODUCING 2-METHYL-BUTYRIC ACID BY BACTERIAL FERMENTATION AJINOMOTO CO., INC. (JP) 2022-08-03 EP disclosed
US-20220213515-A1 METHOD FOR PRODUCING 2-METHYL-BUTYRIC ACID BY BACTERIAL FERMENTATION AJINOMOTO CO., INC. (JP) 2022-07-07 US disclosed
CN-110632227-B Method for distinguishing Liuyang fermented soya beans, Yangjiang fermented soya beans and Yongchuan fermented soya beans 中南林业科技大学 2022-03-18 CN disclosed
US-11046978-B2 Synthesis of isoprenoids and derivatives WILLIAM MARSH RICE UNIVERSITY (US) 2021-06-29 US disclosed
WO-2021060337-A1 METHOD FOR PRODUCING 2-METHYL-BUTYRIC ACID BY BACTERIAL FERMENTATION AJINOMOTO CO., INC. (JP) 2021-04-01 WO disclosed
US-20190352679-A1 MICROBIAL SYNTHESIS OF ISOPRENOID PRECURSORS, ISOPRENOIDS AND DERIVATIVES INCLUDING PRENYLATED AROMATIC COMPOUNDS WILLIAM MARSH RICE UNIVERSITY 2019-11-21 US disclosed
US-9057063-B2 Genetically modified biological cells O'Keefe, Theresa (US) 2015-06-16 US disclosed
US-8311790-B2 Reverse engineering genome-scale metabolic network reconstructions for organisms with incomplete genome annotation and developing constraints using proton flux states and numerically-determined sub-systems UNIVERSITY OF DELAWARE (US) 2012-11-13 US disclosed
US-20100304432-A1 GENETICALLY MODIFIED BIOLOGICAL CELLS O'KEEFE, THERESA 2010-12-02 US disclosed
US-20090259451-A1 REVERSE ENGINEERING GENOME-SCALE METABOLIC NETWORK RECONSTRUCTIONS FOR ORGANISMS WITH INCOMPLETE GENOME ANNOTATION AND DEVELOPING CONSTRAINTS USING PROTON FLUX STATES AND NUMERICALLY-DETERMINED SUB-SYSTEMS UNIVERSITY OF DELAWARE (US) 2009-10-15 US 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-12606850-B2 Synthesis of beta-hydroxyisovalerate and methods of use CYP51A1, CYP4Z1, CYP2U1 TSHR 1764/4885TP53 1633/4885SLC7A5 2321/4885

“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.