SCHEMBL23812525

SCHEMBL23812525

CNC(=S)Nc1ccccccccc1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.84
MAPT P10636 3/20 0.84
CYP1A2 P05177 2/20 0.84
CYP2C19 P33261 2/20 0.84
CYP2C9 P11712 1/20 0.84
SMN1; SMN2 Q16637 1/20 0.84
ALDH1A1 P00352 4/20 0.73
TAS2R38 P59533 2/20 0.73
CYP3A4 P08684 1/20 0.73
HSD17B10 Q99714 1/20 0.73
KMT2A Q03164 4/20 0.67
MEN1 O00255 2/20 0.67
RAB9A P51151 2/20 0.67
NPC1 O15118 1/20 0.67
NOX1 Q9Y5S8 1/20 0.67
MAOA P21397 2/20 0.59
MAOB P27338 2/20 0.59
LMNA P02545 1/20 0.59
HPGD P15428 1/20 0.59
EPHX1 P07099 1/20 0.59

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
SCHEMBL1276402 1.00 GAA (0.84) GAAMAPTCYP1A2CYP2C19CYP2C9
SCHEMBL11684405 0.93 ALDH1A1 (0.77) GAAMAPTCYP1A2CYP2C19CYP2C9
SCHEMBL11545867 0.92 GAA (1.00) GAAMAPTCYP1A2CYP2C19CYP2C9
SCHEMBL11546140 0.87 GAA (0.72) GAAMAPTCYP1A2CYP2C19CYP2C9
SCHEMBL132620 0.85 ALDH1A1 (1.00) GAAMAPTCYP1A2CYP2C19ALDH1A1
SCHEMBL14360821 0.84 ALDH1A1 (0.70) GAAMAPTCYP1A2CYP2C19CYP2C9
SCHEMBL11828149 0.82 MAPT (0.73) GAAMAPTCYP1A2CYP2C19CYP2C9
SCHEMBL9470190 0.82 ALDH1A1 (0.94) GAAMAPTCYP1A2CYP2C19ALDH1A1
SCHEMBL8956322 0.82 ALDH1A1 (0.94) GAAMAPTCYP1A2CYP2C19CYP2C9
SCHEMBL9526913 0.82 GAA (0.75) GAAMAPTCYP1A2CYP2C19CYP2C9

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-20210283271-A1 RAAV WITH CHEMICALLY MODIFIED CAPSID CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2021-09-16 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-20210283271-A1 RAAV WITH CHEMICALLY MODIFIED CAPSID IGF2R, CFH, M6PR GAA 1009/4885MAPT 1734/4885CYP1A2 2967/4885

“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.