SCHEMBL17547869

SCHEMBL17547869

CC(C)c1c(-c2cccc(C(=O)N3CCN(C)CC3)c2)[nH]c2c(C#N)cnn2c1=O

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 6/20 0.47
▸ TLR7 Q9NYK1 6/20 0.47
▸ TLR9 Q9NR96 5/20 0.47
▸ PARP1 P09874 2/20 0.44
▸ PIK3CD O00329 1/20 0.43
▸ PIK3CA P42336 1/20 0.43
▸ PIK3CB P42338 1/20 0.43
▸ PIK3CG P48736 1/20 0.43
▸ KCNH2 Q12809 1/20 0.43
▸ CYP11B2 P19099 2/20 0.42
▸ OTUD7B Q6GQQ9 2/20 0.41
▸ ADORA2A P29274 1/20 0.41
▸ TNIK Q9UKE5 1/20 0.40
▸ CYP11B1 P15538 1/20 0.40
▸ ERN1 O75460 3/20 0.40
▸ KDM4E B2RXH2 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
SCHEMBL16092555 0.92 TLR9 (0.49) TLR8TLR7TLR9CYP11B2OTUD7B
SCHEMBL16092552 0.85 BRD4 (0.37) PARP1CYP11B2
SCHEMBL16092522 0.83 MEN1 (0.40) TLR8TLR7TLR9CYP11B2CYP11B1
SCHEMBL16092280 0.81 TTK (0.41) PIK3CAKDM4E
SCHEMBL16092293 0.81 KDM5A (0.39) CYP11B2CYP11B1
SCHEMBL16092243 0.81 KDM5A (0.43) KDM4E
SCHEMBL16092493 0.81 KDM5B (0.48) —
SCHEMBL16092534 0.80 EGLN1 (0.43) KDM4E
SCHEMBL17085740 0.80 KDM5A (0.39) —
SCHEMBL16050761 0.80 KDM5A (0.41) —

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-10035801-B2 Pyrazolo compounds and uses thereof GENENTECH, INC. (US) 2018-07-31 — — US disclosed
US-10035801-B2 Pyrazolo compounds and uses thereof GENENTECH, INC. (US) 2018-07-31 — — US disclosed
US-20160060267-A1 PYRAZOLO COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2016-03-03 — — US disclosed
US-20160060267-A1 PYRAZOLO COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2016-03-03 — — 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-10035801-B2 Pyrazolo compounds and uses thereof KDM5A, KDM5C, KDM5B TLR8 3005/4885TLR7 3290/4885TLR9 3308/4885
US-20160060267-A1 PYRAZOLO COMPOUNDS AND USES THEREOF KDM5A, KDM5C, KDM5B TLR8 3005/4885TLR7 3290/4885TLR9 3308/4885

“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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