SCHEMBL19685553

SCHEMBL19685553

C=CCc1c(I)ccc(O)c1OCc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
HPGD P15428 2/20 0.39
CYP1A2 P05177 1/20 0.38
PTGS1 P23219 1/20 0.38
SLC6A2 P23975 1/20 0.38
CYP2C19 P33261 1/20 0.38
PTGS2 P35354 1/20 0.38
SLC6A3 Q01959 1/20 0.38
HIF1A Q16665 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
BCHE P06276 4/20 0.37
APP P05067 1/20 0.37
HTR1A P08908 1/20 0.36
ADRA1D P25100 1/20 0.36
ADRA1A P35348 1/20 0.36
ADRA1B P35368 1/20 0.36
ALDH1A1 P00352 2/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL18968249 0.84 ALDH1A1 (0.36) HPGDCYP1A2CYP2C19BCHEAPP
SCHEMBL7560809 0.76 LMNA (0.43) LMNAHPGDCYP1A2PTGS1SLC6A2
SCHEMBL7561778 0.75 CYP2C19 (0.41) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL7562101 0.73 ALDH1A1 (0.45) LMNAHPGDCYP1A2PTGS1SLC6A2
SCHEMBL10689679 0.72 HTR1A (0.48) LMNAHPGDCYP1A2PTGS1SLC6A2
SCHEMBL4238441 0.71 CYP2C19 (0.42) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL16684894 0.71 ALOX5AP (0.41) LMNAHPGDCYP1A2CYP2C19BCHE
SCHEMBL18960826 0.71 PTPN1 (0.43) LMNAHPGDBCHEHTR1AADRA1D
SCHEMBL877466 0.70 PDE5A (0.41) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL2030039 0.70 ALDH1A1 (0.60) LMNAHPGDPTGS1APPALDH1A1

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-20170347654-A1 Herbicidal Compounds SYNGENTA PARTICIPATIONS AG (CH) 2017-12-07 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-20170347654-A1 Herbicidal Compounds DDT, GLRX3, AGXT LMNA 2013/4885HPGD 434/4885CYP1A2 89/4885

“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.