SCHEMBL17208355

SCHEMBL17208355

CO/C=C/C(=O)CC(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 1/20 0.37
LDHA P00338 1/20 0.36
SRR Q9GZT4 1/20 0.36
NFE2L2 Q16236 5/20 0.36
HCAR2 Q8TDS4 2/20 0.36
KEAP1 Q14145 1/20 0.36
GSK3B P49841 2/20 0.34
TSHR P16473 5/20 0.33
POLB P06746 2/20 0.33
POLA1 P09884 1/20 0.33
BACE1 P56817 3/20 0.32
APP P05067 2/20 0.30
CYP2D6 P10635 2/20 0.30
CYP2C9 P11712 2/20 0.30
HSD17B10 Q99714 2/20 0.30
KDM4E B2RXH2 2/20 0.30
CYP2C19 P33261 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
MEN1 O00255 1/20 0.30

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
SCHEMBL10815076 1.00 EGLN1 (0.37) EGLN1LDHASRRNFE2L2HCAR2
SCHEMBL6284324 0.81 POLB (0.50) NFE2L2HCAR2KEAP1GSK3BTSHR
SCHEMBL4534469 0.77 CASP1 (0.39) EGLN1LDHASRRHCAR2POLB
SCHEMBL4534473 0.77 CASP1 (0.39) EGLN1LDHASRRHCAR2POLB
SCHEMBL1259298 0.75
SCHEMBL1259300 0.75
SCHEMBL6916368 0.72
SCHEMBL15756156 0.71
Propionic Acid SCHEMBL28002953 0.71 FFAR3 (0.48) EGLN1HCAR2TSHRLMNATP53
SCHEMBL6833025 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9327281-B2 Carbon-dioxide compound and catalyst MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2016-05-03 US disclosed
US-9327281-B2 Carbon-dioxide compound and catalyst MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2016-05-03 US disclosed
US-20150306590-A1 CARBON-DIOXIDE COMPOUND AND CATALYST MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2015-10-29 US disclosed
US-20150306590-A1 CARBON-DIOXIDE COMPOUND AND CATALYST MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2015-10-29 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-20150306590-A1 CARBON-DIOXIDE COMPOUND AND CATALYST MT-CO2, CNOT9, SCO2 EGLN1 4089/4885LDHA 1483/4885SRR 4802/4885

“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.