SCHEMBL7970243

SCHEMBL7970243

CNC(=O)c1sccc1Cl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.56
ALDH1A1 P00352 3/20 0.56
MAPT P10636 3/20 0.56
AGTR1 P30556 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
PKM P14618 1/20 0.56
KMT2A Q03164 4/20 0.49
HTT P42858 1/20 0.49
OPRM1 P35372 1/20 0.48
MAPK1 P28482 1/20 0.48
ATM Q13315 1/20 0.48
CASP3 P42574 2/20 0.47
SENP8 Q96LD8 2/20 0.47
SENP7 Q9BQF6 2/20 0.47
SENP6 Q9GZR1 2/20 0.47
F10 P00742 2/20 0.45
MEN1 O00255 1/20 0.42
POLB P06746 1/20 0.42
KDM4E B2RXH2 1/20 0.42
TLR8 Q9NR97 1/20 0.42

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
SCHEMBL13485774 0.86 GAA (0.57) GAAALDH1A1MAPTAGTR1TDP1
SCHEMBL1859781 0.83 GAA (0.69) GAAALDH1A1MAPTAGTR1TDP1
SCHEMBL4370162 0.80 ALDH1A1 (0.56) GAAALDH1A1MAPTAGTR1TDP1
Hydrochloric Acid SCHEMBL4948754 0.78 ALDH1A1 (0.54) GAAALDH1A1MAPTAGTR1TDP1
SCHEMBL13940487 0.78 GAA (0.45) GAAALDH1A1MAPTMAPK1KDM4E
SCHEMBL7983727 0.78 GAA (0.67) GAAALDH1A1PKMKMT2APOLB
SCHEMBL2225907 0.77
SCHEMBL155500 0.77
SCHEMBL6360047 0.77 OPRM1 (0.52) GAAALDH1A1MAPTAGTR1TDP1
SCHEMBL15296739 0.77 OPRM1 (0.49) GAAALDH1A1MAPTAGTR1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
US-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 US disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 US disclosed
WO-2010001946-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF アステラス製薬株式会社 (JP) 2010-01-07 WO 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-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF HSD11B1, HSD11B2, HSD3B1 GAA 1904/4885ALDH1A1 359/4885MAPT 1571/4885

“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.