SCHEMBL21847251

SCHEMBL21847251

CSC1=Nc2sc(C)c(C)c2C(c2ccc(NC(C)=O)cc2)=NN1Cc1ccc(O)nc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RGS12 O14924 1/20 0.34
ADRB2 P07550 1/20 0.34
BRD4 O60885 8/20 0.33
BRD2 P25440 2/20 0.33
BRD3 Q15059 2/20 0.33
FYN P06241 1/20 0.33
SULT1A1 P50225 1/20 0.32
BRDT Q58F21 2/20 0.32
HDAC1 Q13547 2/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 1/20 0.31
MTOR P42345 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
TOP2A P11388 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL21915465 0.88 ALDH1A1 (0.37) RGS12BRD4MEN1LMNAGAA
SCHEMBL21847201 0.87 CCNE2 (0.40) BRD4MEN1GAAKMT2AMTOR
SCHEMBL21847310 0.84 BRD4 (0.33) BRD4BRD2BRD3BRDTHDAC1
SCHEMBL21847271 0.84 SLC22A12 (0.32) MEN1LMNAGAAKMT2AALDH1A1
SCHEMBL21847244 0.82 NR3C1 (0.37) BRD4FYNLMNAGAAKMT2A
SCHEMBL21847159 0.79 FYN (0.34) RGS12ADRB2BRD4BRD2BRD3
SCHEMBL21847329 0.78 CCNE2 (0.39) MEN1GAAKMT2AMTORALDH1A1
SCHEMBL21847132 0.78 BRD4 (0.48) BRD4BRD2BRD3BRDTHDAC1
SCHEMBL21847301 0.73 POLB (0.37) MEN1LMNAGAAKMT2ACYP3A4
SCHEMBL21847266 0.70 RAB9A (0.39) MEN1LMNAKMT2ACYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11186588-B2 6H-thieno[2,3-e][1,2,4]triazolo[3,4-c][1,2,4]triazepine derivative AYUMI PHARMACEUTICAL CORPORATION (JP) 2021-11-30 US disclosed
US-11186588-B2 6H-thieno[2,3-e][1,2,4]triazolo[3,4-c][1,2,4]triazepine derivative AYUMI PHARMACEUTICAL CORPORATION (JP) 2021-11-30 US disclosed
US-20210130367-A1 6H-THIENO[2,3-e][1,2,4]TRIAZOLO[3,4-c][1,2,4]TRIAZEPINE DERIVATIVE AYUMI PHARMACEUTICAL CORPORATION (JP) 2021-05-06 US disclosed
US-20210130367-A1 6H-THIENO[2,3-e][1,2,4]TRIAZOLO[3,4-c][1,2,4]TRIAZEPINE DERIVATIVE AYUMI PHARMACEUTICAL CORPORATION (JP) 2021-05-06 US disclosed
EP-3640253-A1 6H-THIENO[2,3-E][1,2,4]TRIAZOLO[3,4-C][1,2,4]TRIAZEPINE DERIVATIVE AYUMI Pharmaceutical Corporation (JP) 2020-04-22 EP disclosed
EP-3640253-A1 6H-THIENO[2,3-E][1,2,4]TRIAZOLO[3,4-C][1,2,4]TRIAZEPINE DERIVATIVE AYUMI Pharmaceutical Corporation (JP) 2020-04-22 EP 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 (2 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-20210130367-A1 6H-THIENO[2,3-e][1,2,4]TRIAZOLO[3,4-c][1,2,4]TRIAZEPINE DERIVATIVE BRD4, BRD3, BRD2 RGS12 3285/4885ADRB2 789/4885BRD4 1/4885
US-11186588-B2 6H-thieno[2,3-e][1,2,4]triazolo[3,4-c][1,2,4]triazepine derivative BRD4, BRD3, BRD2 RGS12 3285/4885ADRB2 789/4885BRD4 1/4885

“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.