SCHEMBL10154099

SCHEMBL10154099

CNS(=O)(=O)CCc1cccc(F)c1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.57
SLC6A3 Q01959 2/20 0.41
DAO P14920 2/20 0.41
GPR84 Q9NQS5 1/20 0.40
PTGES2 Q9H7Z7 1/20 0.40
NR3C2 P08235 1/20 0.40
IDO1 P14902 2/20 0.40
DRD2 P14416 1/20 0.40
SLC6A4 P31645 1/20 0.40
AGXT P21549 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL5460648 0.83 TAAR1 (0.51) TAAR1DAOIDO1AGXTMEN1
SCHEMBL6927695 0.80 TAAR1 (0.57) TAAR1SLC6A3DAOIDO1DRD2
SCHEMBL23732878 0.80 TAAR1 (0.57) TAAR1GPR84IDO1AGXT
SCHEMBL10154041 0.79 TAAR1 (0.52) TAAR1PTGES2IDO1L3MBTL1
SCHEMBL6793104 0.78 IDO1 (0.59) TAAR1PTGES2IDO1MEN1KMT2A
SCHEMBL2239914 0.77 TAAR1 (0.53) TAAR1SLC6A3DAOGPR84IDO1
SCHEMBL4881416 0.77 TAAR1 (0.58) TAAR1SLC6A3DAONR3C2IDO1
SCHEMBL775898 0.77 TAAR1 (0.53) TAAR1SLC6A3DAONR3C2IDO1
SCHEMBL10879373 0.75 TSHR (0.51) MEN1KMT2A
SCHEMBL6988122 0.75 TAAR1 (0.54) TAAR1SLC6A3DAONR3C2

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-20120165309-A1 HETERO RING DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-06-28 US disclosed
WO-2010092962-A1 HETERO RING DERIVATIVE アステラス製薬株式会社 (JP) 2010-08-19 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-20120165309-A1 HETERO RING DERIVATIVE IL2, PIK3R2, IL2RA TAAR1 2247/4885SLC6A3 4731/4885DAO 2784/4885

“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.