SCHEMBL2814623

SCHEMBL2814623

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nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.67
SRR Q9GZT4 1/20 0.67
EGLN1 Q9GZT9 3/20 0.43
LMNA P02545 3/20 0.43
ALKBH5 Q6P6C2 1/20 0.43
SUCNR1 Q9BXA5 1/20 0.43
TSHR P16473 4/20 0.40
OR51E2 Q9H255 3/20 0.40
CA4 P22748 2/20 0.40
FFAR3 O14843 1/20 0.40
GLRA1 P23415 1/20 0.40
SLC6A9 P48067 1/20 0.40
MAPK1 P28482 1/20 0.39
SLC13A3 Q8WWT9 1/20 0.39
KDM4E B2RXH2 2/20 0.38
SLC22A6 Q4U2R8 1/20 0.38
CYP2D6 P10635 3/20 0.35
CYP2C19 P33261 1/20 0.35
NFKB1 P19838 1/20 0.35
PMP22 Q01453 1/20 0.35

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
Malonic Acid SCHEMBL133973 0.86
Malonic Acid SCHEMBL538116 0.86 LDHA (0.90) LDHASRREGLN1LMNAALKBH5
Malonic Acid SCHEMBL107286 0.86
Malonic Acid SCHEMBL14989007 0.86 LDHA (0.90) LDHASRREGLN1LMNAALKBH5
Oxaloacetate SCHEMBL898612 0.84 LDHA (0.57) LDHASRREGLN1LMNAALKBH5
Oxaloacetate SCHEMBL4298763 0.84 LDHA (0.57) LDHASRREGLN1LMNAALKBH5
Oxaloacetate SCHEMBL8464 0.84
SCHEMBL1763371 0.83 FFAR3 (0.53) LDHASRRTSHROR51E2FFAR3
Malonic Acid SCHEMBL28854453 0.82 LDHA (0.82) LDHASRREGLN1LMNAALKBH5
Malonic Acid SCHEMBL11307216 0.82

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100249451-A1 PROCESS FOR THE PREPARATION OF SUBSTITUTED BENZILIC ACID FROM SUBSTITUTED BENZILS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2010-09-30 US disclosed
EP-0408255-B1 Thermoplastic resin composition SUMITOMO CHEMICAL CO (JP) 1995-05-17 EP disclosed
US-5284681-A Bringing into contact with water, drying in air SUMITOMO CHEMICAL CO., LTD. (JP) 1994-02-08 US disclosed
US-5182151-A Polyphenylene ether, propylene graft polymer, rubber, molding material SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-01-26 US disclosed
EP-0408255-A1 Thermoplastic resin composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-01-16 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-20100249451-A1 PROCESS FOR THE PREPARATION OF SUBSTITUTED BENZILIC ACID FROM SUBSTITUTED BENZILS KCNC1, HRH2, SMARCC2 LDHA 824/4885SRR 2803/4885EGLN1 1464/4885

“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.