SCHEMBL20914227

SCHEMBL20914227

COc1cccc2oc(-c3c(C(=O)N4CCC[C@@H]4CO)[nH]c4c(-c5ccccc5)c(C(F)(F)F)nn4c3=O)nc12

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 2/20 0.37
▸ TRPV1 Q8NER1 3/20 0.36
▸ HCRTR2 O43614 4/20 0.35
▸ SPHK2 Q9NRA0 2/20 0.35
▸ SPHK1 Q9NYA1 1/20 0.35
▸ F2RL3 Q96RI0 6/20 0.34
▸ ABL1 P00519 1/20 0.33
▸ RIN1 Q13671 1/20 0.33
▸ HCRTR1 O43613 1/20 0.33
▸ LMNA P02545 1/20 0.33

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
SCHEMBL20914230 1.00 ROCK2 (0.37) ROCK2TRPV1HCRTR2SPHK2SPHK1
SCHEMBL20914149 0.86 PDE4B (0.35) —
SCHEMBL20819040 0.85 TNKS (0.35) F2RL3
SCHEMBL20913994 0.84 POLB (0.37) F2RL3
SCHEMBL20914091 0.83 TNKS (0.34) F2RL3
SCHEMBL20914008 0.82 TAAR1 (0.33) F2RL3
SCHEMBL20819031 0.82 ARF6 (0.37) F2RL3
SCHEMBL20913986 0.81 TNKS (0.35) F2RL3
SCHEMBL20819079 0.81 TNKS (0.38) F2RL3
SCHEMBL20914203 0.80 TNKS (0.37) F2RL3

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 ROCK2 1703/4885TRPV1 177/4885HCRTR2 2616/4885
US-20190119285-A1 PYRAZOLOPYRIMIDINONE COMPOUNDS AND USES THEREOF NLRP3, NLRP1, P2RX7 ROCK2 1703/4885TRPV1 177/4885HCRTR2 2616/4885

“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.

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