SCHEMBL14375268

SCHEMBL14375268

CC1CCN(CCS(=O)(=O)c2ccccc2)CC1

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.63
▸ KMT2A Q03164 2/20 0.63
▸ ALDH1A1 P00352 3/20 0.56
▸ MAPK1 P28482 1/20 0.56
▸ HTR7 P34969 2/20 0.55
▸ ACHE P22303 2/20 0.55
▸ SIGMAR1 Q99720 5/20 0.54
▸ HTR2A P28223 2/20 0.49
▸ KCNH2 Q12809 2/20 0.49
▸ GAA P10253 1/20 0.49
▸ HTR2C P28335 1/20 0.48
▸ HRH3 Q9Y5N1 1/20 0.46

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
SCHEMBL24732017 0.84 KMT2A (0.58) MEN1KMT2AALDH1A1MAPK1HTR7
SCHEMBL18390001 0.82 MEN1 (0.69) MEN1KMT2AALDH1A1MAPK1HTR7
SCHEMBL14476103 0.82 MEN1 (0.73) MEN1KMT2AALDH1A1MAPK1HTR7
SCHEMBL13604236 0.80 KMT2A (0.71) MEN1KMT2AALDH1A1MAPK1HTR7
SCHEMBL12204584 0.80 ALDH1A1 (0.76) MEN1KMT2AALDH1A1MAPK1HTR7
SCHEMBL15965548 0.79 ALDH1A1 (0.60) MEN1KMT2AALDH1A1MAPK1HTR7
SCHEMBL6245041 0.78 KMT2A (0.67) MEN1KMT2AALDH1A1MAPK1SIGMAR1
SCHEMBL18705122 0.77 KMT2A (0.61) MEN1KMT2AALDH1A1MAPK1HTR7
Hydrochloric Acid SCHEMBL2827786 0.76 KMT2A (0.65) MEN1KMT2AALDH1A1MAPK1SIGMAR1
Hydrochloric Acid SCHEMBL11529235 0.76 KMT2A (0.97) MEN1KMT2AALDH1A1SIGMAR1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070244133-A1 Thienopyrimidines and Thiazolopyrimidines for Use in Medicine ASTRAZENECA AB (SE) 2007-10-18 — — US disclosed
US-20070244133-A1 Thienopyrimidines and Thiazolopyrimidines for Use in Medicine ASTRAZENECA AB (SE) 2007-10-18 — — 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-20070244133-A1 Thienopyrimidines and Thiazolopyrimidines for Use in Medicine CXCR4, CXCR1, CXCR3 MEN1 4261/4885KMT2A 4292/4885ALDH1A1 683/4885

“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.

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