SCHEMBL437202

SCHEMBL437202

CC(=O)C(O)C(O)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.67
TP53 P04637 1/20 0.44
NFKB1 P19838 1/20 0.39
CYP2C19 P33261 1/20 0.39
FFAR3 O14843 1/20 0.38
LCK P06239 1/20 0.38
FYN P06241 1/20 0.38
CYP2C9 P11712 1/20 0.36
PDE4A P27815 1/20 0.36
LMNA P02545 2/20 0.32
CYP3A4 P08684 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32
OR51E2 Q9H255 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
SCHEMBL8746197 1.00 TSHR (0.67) TSHRTP53NFKB1CYP2C19FFAR3
SCHEMBL16807867 1.00 TSHR (0.67) TSHRTP53NFKB1CYP2C19FFAR3
SCHEMBL10054702 1.00 TSHR (0.67) TSHRTP53NFKB1CYP2C19FFAR3
SCHEMBL16140166 1.00 TSHR (0.67) TSHRTP53NFKB1CYP2C19FFAR3
SCHEMBL12654016 1.00 TSHR (0.67) TSHRTP53NFKB1CYP2C19FFAR3
Cadaverine Tartrate SCHEMBL3972251 0.86 TSHR (0.77) TSHRTP53NFKB1CYP2C19FFAR3
Cadaverine Tartrate SCHEMBL305065 0.86 TSHR (0.77) TSHRTP53NFKB1CYP2C19FFAR3
Cadaverine Tartrate SCHEMBL2085067 0.86 TSHR (0.77) TSHRTP53NFKB1CYP2C19FFAR3
Cadaverine Tartrate SCHEMBL3972247 0.86 TSHR (0.77) TSHRTP53NFKB1CYP2C19FFAR3
Cadaverine Tartrate SCHEMBL28136011 0.86 TSHR (0.77) TSHRTP53NFKB1CYP2C19FFAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119198937-A Organic aerosol source analysis method and system based on-line observation of organic molecular markers 上海大学 2024-12-27 CN claimed
CN-119198937-A Organic aerosol source analysis method and system based on-line observation of organic molecular markers 上海大学 2024-12-27 CN disclosed
US-12029735-B2 Polymorphic compounds and uses thereof ALDEYRA THERAPEUTICS, INC. (US) 2024-07-09 US disclosed
US-20240207260-A1 METHODS FOR TREATING CHOLESTASIS MIRUM PHARMACEUTICALS, INC. (US) 2024-06-27 US disclosed
US-20230398226-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL INFECTIONS CIDARA THERAPEUTICS, INC. 2023-12-14 US disclosed
US-11833213-B2 Compositions and methods for the treatment of viral infections CIDARA THERAPEUTICS, INC. (US) 2023-12-05 US disclosed
EP-4252758-A1 METHOD FOR TREATING PAIN BY VANADIUM COMPOUND Shenzhen Fangshengtai Medical Technology Co., Ltd. (CN) 2023-10-04 EP disclosed
US-20230287365-A1 COMPOSITIONS AND METHODS FOR DECREASING INFLAMMATION BETH ISRAEL DEACONESS MEDICAL CENTER, INC. 2023-09-14 US disclosed
US-20230257337-A1 METHOD FOR PRODUCING POLYGYLCEROL ESTERS OF POLYCARBOXYLIC ACIDS ESTERIFIED WITH OXOBUTANOL KETOLIPIX THERAPEUTICS GMBH (DE) 2023-08-17 US disclosed
US-11717549-B2 Steviol glycoside solubility enhancers CARGILL, INCORPORATED (US) 2023-08-08 US disclosed
US-20100130472-A1 BILE ACID RECYCLING INHIBITORS FOR TREATMENT OF OBESITY AND DIABETES SATIOGEN PHARMACEUTICALS, INC. (US) 2010-05-27 US disclosed
US-20100130472-A1 BILE ACID RECYCLING INHIBITORS FOR TREATMENT OF OBESITY AND DIABETES SATIOGEN PHARMACEUTICALS, INC. (US) 2010-05-27 US disclosed
WO-2010049449-A2 NOVEL SALTS OF SUNITINIB LEK PHARMACEUTICALS D.D. (SI) 2010-05-06 WO disclosed
US-20100105794-A1 PHOTOACTIVABLE NITROGEN BASES CIBA CORPORATION (US) 2010-04-29 US disclosed
US-20090277356-A1 Cure Accelerators for Anaerobic Curable Compositions HENKEL CORPORATION (US) 2009-11-12 US disclosed
US-20090281335-A1 Cure Accelerators for Anaerobic Curable Compositions HENKEL CORPORATION (US) 2009-11-12 US disclosed
US-20090278084-A1 Cure accelerators for anaerobic curable compositions HENKEL CORPORATION (US) 2009-11-12 US disclosed
WO-2009104920-A1 ACID SALT OF TOLTERODINE HAVING EFFECTIVE STABILITY FOR TRANSDERMAL DRUG DELIVERY SYSTEM SK CHEMICALS CO., LTD. (KR) 2009-08-27 WO disclosed
US-7501439-B2 Tartrate salt of isofagomine and methods of use AMICUS THERAPEUTICS, INC. (US) 2009-03-10 US disclosed
WO-2008141057-A1 DEUTERATED PIMAVANSERIN 1- (4-FLU0R0BENZYL) -3- (4-ISOBUTOXYBENZYL) -1- ( L-METHYL-PIPERIDIN-4-YL) -UREA AUSPEX PHARMACEUTICALS, INC. (US) 2008-11-20 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 (11 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-12029735-B2 Polymorphic compounds and uses thereof ALDH2, ALDH1A1, ALDH3A1 TSHR 4640/4885TP53 342/4885NFKB1 1723/4885
US-20230398226-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL INFECTIONS FCGR3B, ALB, FCGR1A TSHR 2184/4885TP53 449/4885NFKB1 4291/4885
US-20090277356-A1 Cure Accelerators for Anaerobic Curable Compositions ACLY, ACAD9, CCNY TSHR 4841/4885TP53 3091/4885NFKB1 1552/4885
US-20090278084-A1 Cure accelerators for anaerobic curable compositions EGLN3, INO80, IDH2 TSHR 4522/4885TP53 2773/4885NFKB1 2527/4885
US-20240207260-A1 METHODS FOR TREATING CHOLESTASIS SLC10A1, SLC10A2, NR1H4 TSHR 3795/4885TP53 4809/4885NFKB1 3835/4885
US-11717549-B2 Steviol glycoside solubility enhancers SI, TAS2R7, TAS2R31 TSHR 4189/4885TP53 2053/4885NFKB1 3810/4885
US-11833213-B2 Compositions and methods for the treatment of viral infections FCGR3B, ALB, FCGR1A TSHR 2184/4885TP53 449/4885NFKB1 4291/4885
US-20090281335-A1 Cure Accelerators for Anaerobic Curable Compositions CAT, MRM1, ACLY TSHR 4604/4885TP53 2311/4885NFKB1 2028/4885
US-20230257337-A1 METHOD FOR PRODUCING POLYGYLCEROL ESTERS OF POLYCARBOXYLIC ACIDS ESTERIFIED WITH OXOBUTANOL ACACB, HSD17B12, MCCC2 TSHR 3845/4885TP53 3977/4885NFKB1 1991/4885
US-20230287365-A1 COMPOSITIONS AND METHODS FOR DECREASING INFLAMMATION ENTPD1, ENTPD2, ENTPD5 TSHR 3422/4885TP53 2940/4885NFKB1 1873/4885
US-20100130472-A1 BILE ACID RECYCLING INHIBITORS FOR TREATMENT OF OBESITY AND DIABETES SLC10A1, SLC10A2, ABCB11 TSHR 1089/4885TP53 4716/4885NFKB1 3197/4885

“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.