SCHEMBL20914221

SCHEMBL20914221

Cc1[nH]c2c(-c3ccccc3)c(C#N)nn2c(=O)c1-c1nc2c(OC3CC3)cccc2o1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HTR3A P46098 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ PKM P14618 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL20914077 0.89 TNKS (0.37) MEN1CYP1A2CYP2C9PKMTSHR
SCHEMBL20913968 0.84 KDM4E (0.34) MEN1CYP1A2CYP2C9PKMTSHR
SCHEMBL20837038 0.84 ADORA2A (0.34) MEN1CYP1A2CYP2C9PKMTSHR
SCHEMBL20913931 0.83 KMT2A (0.35) MEN1CYP1A2CYP2C9PKMTSHR
SCHEMBL20914080 0.83 KMT2A (0.32) MEN1CYP1A2CYP2C9PKMTSHR
SCHEMBL20914299 0.83 CYP1A2 (0.35) MEN1CYP1A2CYP2C9PKMTSHR
SCHEMBL20837241 0.82 PLAT (0.35) HTR3AMEN1KMT2A
SCHEMBL20837037 0.81 P2RY6 (0.37) MEN1CYP1A2CYP2C9PKMTSHR
SCHEMBL20837249 0.81 TNKS (0.37) MEN1CYP1A2CYP2C9KMT2A
SCHEMBL20913913 0.81 KCNA5 (0.38) —

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 4 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-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
US-20190119285-A1 PYRAZOLOPYRIMIDINONE COMPOUNDS AND USES THEREOF CHINOOK THERAPEUTICS, INC. 2019-04-25 — — 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 (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 HTR3A 2505/4885MEN1 2785/4885CYP1A2 1015/4885
US-20190119285-A1 PYRAZOLOPYRIMIDINONE COMPOUNDS AND USES THEREOF NLRP3, NLRP1, P2RX7 HTR3A 2505/4885MEN1 2785/4885CYP1A2 1015/4885

“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.

Send feedback