SCHEMBL7129087

SCHEMBL7129087

CS(=O)(=O)N(c1ccccc1)c1ccccc1CCN

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 7/20 0.41
HTR2A P28223 1/20 0.39
ALDH1A1 P00352 1/20 0.38
HTR6 P50406 4/20 0.36
RECQL P46063 1/20 0.36
HTR1A P08908 1/20 0.36
HTR1D P28221 1/20 0.36
HTR1B P28222 1/20 0.36
HTR1F P30939 1/20 0.36
HTR7 P34969 1/20 0.36
DRD3 P35462 1/20 0.36
HRH1 P35367 1/20 0.36
SLC6A2 P23975 1/20 0.35
PKM P14618 1/20 0.34
HMGB1 P09429 1/20 0.34

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
SCHEMBL2634907 0.79 TAAR1 (0.44) TAAR1HTR2AALDH1A1
SCHEMBL27792301 0.75 PKM (0.39) ALDH1A1HTR6PKM
SCHEMBL1704542 0.73 PKM (0.50) ALDH1A1HTR6PKM
SCHEMBL10581186 0.71 HTR1D (0.51) TAAR1HTR2AHTR6RECQLHTR1A
SCHEMBL3842121 0.70 TAAR1 (0.54) TAAR1HTR2AALDH1A1HRH1
SCHEMBL5279627 0.70 KMT2A (0.42) ALDH1A1
SCHEMBL14135576 0.69 KMT2A (0.40) ALDH1A1HTR6PKM
SCHEMBL894821 0.69 KMT2A (0.44) ALDH1A1HMGB1
SCHEMBL8337031 0.67 TAAR1 (0.50) TAAR1HTR2AHTR6HTR1AHTR1D
Hydrochloric Acid SCHEMBL14157101 0.66 TAAR1 (0.48) TAAR1HTR2AHTR6HRH1SLC6A2

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-20030153596-A1 Novel thiourea derivatives and the pharmaceutical compositions containing the same PACIFIC CORPORATION (KR) 2003-08-14 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-20030153596-A1 Novel thiourea derivatives and the pharmaceutical compositions containing the same TAS2R40, TAS1R2, TAS2R45 TAAR1 102/4885HTR2A 198/4885ALDH1A1 2306/4885

“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.