SCHEMBL7125327

SCHEMBL7125327

CC(C)C1CN1S(=O)(=O)c1ccc(F)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.48
MAPT P10636 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
TSHR P16473 2/20 0.45
MMP2 P08253 1/20 0.45
PKM P14618 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HTR7 P34969 2/20 0.42
HTR1A P08908 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
TP53 P04637 1/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PSEN1 P49768 1/20 0.40
PSEN2 P49810 1/20 0.40
APH1B Q8WW43 1/20 0.40

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
SCHEMBL7125321 1.00 TRPA1 (0.48) TRPA1MAPTTDP1TSHRMMP2
SCHEMBL7118457 0.85 L3MBTL1 (0.50) TSHRMMP2PKMKMT2AALDH1A1
SCHEMBL7118462 0.85 L3MBTL1 (0.50) TSHRMMP2PKMKMT2AALDH1A1
SCHEMBL21465092 0.85 L3MBTL1 (0.50) TSHRMMP2PKMKMT2AALDH1A1
SCHEMBL7115725 0.84 MAPT (0.46) TRPA1MAPTTDP1TSHRMMP2
SCHEMBL7115722 0.84 MAPT (0.46) TRPA1MAPTTDP1TSHRMMP2
SCHEMBL7115720 0.84 MAPT (0.46) TRPA1MAPTTDP1TSHRMMP2
SCHEMBL7129555 0.83 TSHR (0.65) TSHRMMP2MEN1KMT2AALDH1A1
SCHEMBL7129560 0.83 TSHR (0.65) TSHRMMP2MEN1KMT2AALDH1A1
SCHEMBL10037151 0.81 TRPA1 (0.61) TRPA1MAPTTDP1TSHRKMT2A

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-20030153771-A1 Large scale synthesis of optically pure aziridines LEXICON PHARMACEUTICALS, INC. 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-20030153771-A1 Large scale synthesis of optically pure aziridines QDPR, AZI2, NISCH TRPA1 4418/4885MAPT 4370/4885TDP1 4670/4885

“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.