SCHEMBL852208

SCHEMBL852208

O=C(O)C(O)(Cc1ccccc1)C(O)(Cc1ccccc1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.59
HIF1A Q16665 1/20 0.59
CYP2C9 P11712 2/20 0.52
CYP2C19 P33261 2/20 0.52
CYP1A2 P05177 2/20 0.52
FDPS P14324 1/20 0.52
CES1 P23141 2/20 0.46
CES2 O00748 1/20 0.46
AKR1B1 P15121 1/20 0.46
MMP8 P22894 1/20 0.44
KEAP1 Q14145 1/20 0.43
SLC6A2 P23975 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43
ARG1 P05089 1/20 0.42
ARG2 P78540 1/20 0.42
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP3A4 P08684 1/20 0.42
HDAC8 Q9BY41 2/20 0.40

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
SCHEMBL15189769 1.00 SMN1; SMN2 (0.59) SMN1; SMN2HIF1ACYP2C9CYP2C19CYP1A2
SCHEMBL4975583 0.87 SMN1; SMN2 (0.52) SMN1; SMN2HIF1ACYP2C9CYP2C19CYP1A2
SCHEMBL2036359 0.87 SMN1; SMN2 (0.52) SMN1; SMN2HIF1ACYP2C9CYP2C19CYP1A2
SCHEMBL2032810 0.87 SMN1; SMN2 (0.52) SMN1; SMN2HIF1ACYP2C9CYP2C19CYP1A2
SCHEMBL9817479 0.87 SMN1; SMN2 (0.52) SMN1; SMN2HIF1ACYP2C9CYP2C19CYP1A2
SCHEMBL28125890 0.82 HIF1A (0.55) SMN1; SMN2HIF1ACYP2C9CYP2C19CYP1A2
SCHEMBL419615 0.81 SMN1; SMN2 (0.59) SMN1; SMN2HIF1ACYP2C9CYP2C19CYP1A2
SCHEMBL244942 0.81 SMN1; SMN2 (0.59) SMN1; SMN2HIF1ACYP2C9CYP2C19CYP1A2
SCHEMBL3805248 0.81 SMN1; SMN2 (0.59) SMN1; SMN2HIF1ACYP2C9CYP2C19CYP1A2
SCHEMBL13519211 0.80 SMN1; SMN2 (0.43) SMN1; SMN2HIF1AALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116271245-A Bionic tendon sheath membrane with medicine slow-release function and preparation method thereof 河北医科大学第三医院 2023-06-23 CN claimed
US-8778069-B2 Phase change inks containing oligomeric rosin esters XEROX CORPORATION (US) 2014-07-15 US claimed
US-20140137767-A1 Phase Change Inks Containing Oligomeric Rosin Esters XEROX CORPORATION (US) 2014-05-22 US claimed
EP-1919909-B1 SYNTHETIC METHODS AND INTERMEDIATES FOR STEREOISOMERIC COMPOUNDS USEFUL FOR THE TREATMENT OF GASTROINTESTINAL AND CENTRAL NERVOUS SYSTEM DISORDERS ARMETHEON INC (US) 2013-08-21 EP claimed
WO-2009084024-A2 A PROCESS FOR THE PREPARATION OF R-SIT AGLIPTIN AND ITS PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF GLENMARK GENERICS LIMITED (IN) 2009-07-09 WO claimed
JP-9012515-A None JP disclosed
CN-112839715-B Process for producing compound for inhibiting SHP2 activity 诺华股份有限公司 2024-12-03 CN disclosed
US-12138262-B2 Process of manufacture of a compound for inhibiting the activity of SHP2, as well as products resulting from acid addition NOVARTIS AG (CH) 2024-11-12 US disclosed
EP-3807243-B1 A NOVEL PROCESS FOR THE PREPARATION OF TAPENTADOL PHARMATHEN SA (GR) 2024-05-22 EP disclosed
CN-112424177-B One-pot organic pseudo-catalytic C-H activation method for preparing vortioxetine and vortioxetine intermediate VIO制药公司 2024-05-03 CN disclosed
US-20240024312-A1 PHARMACEUTICAL COMPOSITIONS OF SITAGLIPTIN ZYDUS LIFESCIENCES LIMITED (IN) 2024-01-25 US disclosed
US-11851503-B2 Antiplasmodial compounds UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2023-12-26 US disclosed
EP-1019434-A2 INHIBITORS OF METALLOPROTEINASES, THEIR THERAPEUTIC USE, AND PROCESS FOR THE PRODUCTION OF THE STARTING COMPOUND IN THEIR SYNTHESIS POLIFARMA S.p.A. (IT) 2000-07-19 EP disclosed
WO-2000024719-A1 PROSTAGLANDIN ENDOPEROXIDE H SYNTHASE BIOSYNTHESIS INHIBITORS ABBOTT LABORATORIES (US) 2000-05-04 WO disclosed
WO-2000010551-A2 METHODS OF USING AND COMPOSITIONS COMPRISING DOPAMINE REUPTAKE INHIBITORS SEPRACOR INC. (US) 2000-03-02 WO disclosed
CN-1225631-A Bioconjugates of manganese or iron complexes of nitrogen-contg. macrocyclic ligands effective as catalysis for dismutating superoxide MONSANTO CO (US) 1999-08-11 CN disclosed
WO-1999003878-A2 INHIBITORS OF METALLOPROTEINASES, THEIR THERAPEUTIC USE, AND PROCESS FOR THE PRODUCTION OF THE STARTING COMPOUND IN THEIR SYNTHESIS POLIFARMA S.P.A. (IT) 1999-01-28 WO disclosed
JP-H0912515-A PRODUCTION OF OPTICALLY ACTIVE 1-(2,4-DICHLOROPHENYL) ETHYLAMINE SUMITOMO CHEM CO LTD 1997-01-14 JP disclosed
US-4571424-A SALT FORMATION WITH MANDELIC ACID, PRECIPITATION AND EXTRACTION A/S FERROSAN (DK) 1986-02-18 US disclosed
JP-H00912515-A 0001-01-01 JP 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 (3 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-20240024312-A1 PHARMACEUTICAL COMPOSITIONS OF SITAGLIPTIN DPP4, NT5C, DPP7 SMN1; SMN2 596/4885HIF1A 4204/4885CYP2C9 274/4885
US-12138262-B2 Process of manufacture of a compound for inhibiting the activity of SHP2, as well as products resulting from acid addition PTPN5, PTPN7, PTPN1 SMN1; SMN2 3575/4885HIF1A 3982/4885CYP2C9 2018/4885
US-11851503-B2 Antiplasmodial compounds MGST3, G6PD, GPX4 SMN1; SMN2 2960/4885HIF1A 4082/4885CYP2C9 3315/4885

“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.