SCHEMBL20837331

SCHEMBL20837331

NCC1CCCCN1C(=O)NN

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 7/20 0.43
MAPT P10636 1/20 0.41
ALDH1A1 P00352 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
POLB P06746 1/20 0.39
EPHX2 P34913 1/20 0.36
HSD11B1 P28845 1/20 0.36
KDM4E B2RXH2 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KMT2A Q03164 1/20 0.34
ATM Q13315 1/20 0.34

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
SCHEMBL20837081 0.86 HRH3 (0.41) HRH3MAPTALDH1A1L3MBTL1POLB
SCHEMBL20837328 0.80 POLB (0.42) HRH3MAPTALDH1A1L3MBTL1POLB
SCHEMBL1596887 0.79 POLB (0.42) HRH3MAPTL3MBTL1POLBKMT2A
SCHEMBL2679802 0.79 POLB (0.42) HRH3MAPTL3MBTL1POLBKMT2A
SCHEMBL1596883 0.79 POLB (0.42) HRH3MAPTL3MBTL1POLBKMT2A
Hydrochloric Acid SCHEMBL20570928 0.78 POLB (0.41) HRH3MAPTL3MBTL1POLBKMT2A
Hydrochloric Acid SCHEMBL30223574 0.78 POLB (0.41) HRH3MAPTALDH1A1L3MBTL1POLB
SCHEMBL17366260 0.78 CHRM2 (0.45) L3MBTL1POLB
SCHEMBL29116530 0.77 TSHR (0.40) HRH3MAPTALDH1A1L3MBTL1POLB
SCHEMBL28579495 0.76 HRH3 (0.45) HRH3MAPTALDH1A1L3MBTL1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10738056-B2 Pyrazolopyrimidinone compounds and uses thereof ADURO BIOTECH INC. (US) 2020-08-11 US disclosed
US-20190119285-A1 PYRAZOLOPYRIMIDINONE COMPOUNDS AND USES THEREOF CHINOOK THERAPEUTICS, INC. 2019-04-25 US disclosed
WO-2019055750-A1 PYRAZOLOPYRIMIDINONE COMPOUNDS AND USES THEREOF Aduro Biotech, Inc. (US) 2019-03-21 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 (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-10738056-B2 Pyrazolopyrimidinone compounds and uses thereof NLRP3, NLRP1, P2RX7 HRH3 1045/4885MAPT 214/4885ALDH1A1 1246/4885
US-20190119285-A1 PYRAZOLOPYRIMIDINONE COMPOUNDS AND USES THEREOF NLRP3, NLRP1, P2RX7 HRH3 1045/4885MAPT 214/4885ALDH1A1 1246/4885

“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.