SCHEMBL16145709

SCHEMBL16145709

C[C@H](CCCC[C@@H](O)CC(=O)O)O[Si](C)(C)C(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 4/20 0.47
ACACB O00763 1/20 0.36
ACACA Q13085 1/20 0.36
SLC22A6 Q4U2R8 1/20 0.35
FFAR4 Q5NUL3 1/20 0.33
FFAR1 O14842 1/20 0.33
MAPT P10636 1/20 0.33
GABRR1 P24046 2/20 0.32
LMNA P02545 1/20 0.32
PGD P52209 1/20 0.30
MMP12 P39900 1/20 0.30
MMP13 P45452 1/20 0.30
FAAH O00519 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
SCHEMBL16669141 0.83 FFAR4 (0.39) GPR84SLC22A6FFAR4FFAR1LMNA
SCHEMBL4939304 0.81 FOLH1 (0.35) SLC22A6FFAR4FFAR1LMNA
SCHEMBL4943234 0.81 FOLH1 (0.35) SLC22A6FFAR4FFAR1LMNA
SCHEMBL4180699 0.80 PGD (0.33) SLC22A6PGD
SCHEMBL4455207 0.80 PGD (0.33) SLC22A6PGD
SCHEMBL4180706 0.80 PGD (0.33) SLC22A6PGD
SCHEMBL13619245 0.80 CA2 (0.31)
SCHEMBL4317383 0.77 GABRP (0.41) MAPT
SCHEMBL4317387 0.77 GABRP (0.41) MAPT
SCHEMBL20582003 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9534008-B2 Small molecule compounds that control plant- and insect-pathogenic nematodes CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2017-01-03 US disclosed
US-9487551-B2 Small molecule compounds that control mammal-pathogenic nematodes CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2016-11-08 US disclosed
US-9445596-B2 Small molecule compounds for the control of nematodes CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2016-09-20 US disclosed
US-20140364386-A1 Small Molecule Compounds That Control Plant- and Insect-Pathogenic Nematodes CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2014-12-11 US disclosed
US-20140303102-A1 Small Molecule Compounds that Control Mammal-Pathogenic Nematodes CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2014-10-09 US disclosed
US-20140303360-A1 Small Molecule Compounds for the Control of Nematodes CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2014-10-09 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 (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-20140303360-A1 Small Molecule Compounds for the Control of Nematodes MAVS, EMG1, PINK1 GPR84 1268/4885ACACB 731/4885ACACA 1470/4885
US-20140364386-A1 Small Molecule Compounds That Control Plant- and Insect-Pathogenic Nematodes HNMT, EMG1, API5 GPR84 4338/4885ACACB 855/4885ACACA 1105/4885
US-20140303102-A1 Small Molecule Compounds that Control Mammal-Pathogenic Nematodes EMG1, HNMT, MSN GPR84 3577/4885ACACB 298/4885ACACA 350/4885

“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.