SCHEMBL801200

SCHEMBL801200

CC/C=C\CC(CC(=O)O)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 5/20 0.59
GRIK2 Q13002 5/20 0.59
FOLH1 Q04609 2/20 0.43
FPR2 P25090 1/20 0.40
ALDH1A1 P00352 5/20 0.39
CYP19A1 P11511 4/20 0.39
PPARG P37231 3/20 0.39
OXER1 Q8TDS5 3/20 0.39
MAPT P10636 3/20 0.39
RXRA P19793 2/20 0.39
FFAR1 O14842 2/20 0.39
TDP1 Q9NUW8 3/20 0.38
CHRM1 P11229 1/20 0.38
AKR1A1 P14550 1/20 0.38
CHRM3 P20309 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
ADRA1A P35348 1/20 0.38
HRH1 P35367 1/20 0.38
DRD3 P35462 1/20 0.38

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
SCHEMBL14385493 1.00 GRIK1 (0.59) GRIK1GRIK2FOLH1FPR2ALDH1A1
SCHEMBL12231028 0.84 GRIK1 (0.43) GRIK1GRIK2FOLH1CYP19A1PPARG
SCHEMBL9049408 0.83 GRIK1 (0.63) GRIK1GRIK2FPR2ALDH1A1CYP19A1
SCHEMBL9306152 0.83 GRIK1 (0.63) GRIK1GRIK2FPR2ALDH1A1CYP19A1
SCHEMBL5494285 0.83 GRIK1 (0.63) GRIK1GRIK2FPR2ALDH1A1CYP19A1
SCHEMBL9306159 0.83 GRIK1 (0.63) GRIK1GRIK2FPR2ALDH1A1CYP19A1
SCHEMBL5494288 0.83 GRIK1 (0.63) GRIK1GRIK2FPR2ALDH1A1CYP19A1
SCHEMBL14485864 0.81 GRIK1 (0.53) GRIK1GRIK2FOLH1FPR2ALDH1A1
SCHEMBL28401839 0.81 F7 (0.50) ALDH1A1CYP19A1PPARGMAPTFFAR1
SCHEMBL40728 0.81 GRIK1 (0.58) GRIK1GRIK2FOLH1TDP1CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120068118-A1 NANOCRYSTAL DOPED MATRIXES SAMSUNG ELECTRONICS CO., LTD. (KR) 2012-03-22 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-20120068118-A1 NANOCRYSTAL DOPED MATRIXES STRA6, EPHA6, PIR GRIK1 3775/4885GRIK2 2965/4885FOLH1 4010/4885

“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.