SCHEMBL21712416

SCHEMBL21712416

CCOCc1nc2c(N)nc3cccc(OCC(C)O)c3c2[nH]1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 6/20 0.35
CDK8 P49336 1/20 0.35
CDK5 Q00535 1/20 0.35
ROCK1 Q13464 1/20 0.35
CLK4 Q9HAZ1 1/20 0.35
DCPS Q96C86 5/20 0.34
DHFR P00374 5/20 0.34
MCHR1 Q99705 2/20 0.34
TLR7 Q9NYK1 2/20 0.33
NUDT1 P36639 1/20 0.33
NCF1 P14598 3/20 0.33
GRK3 P35626 1/20 0.31
ADRB2 P07550 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
SCHEMBL30662183 1.00 TLR8 (0.35) TLR8CDK8CDK5ROCK1CLK4
SCHEMBL21712357 0.92 TLR8 (0.43) TLR8CDK8CDK5ROCK1CLK4
SCHEMBL30662197 0.92 TLR8 (0.43) TLR8CDK8CDK5ROCK1CLK4
SCHEMBL20547228 0.90 TLR8 (0.36) TLR8CDK8CDK5ROCK1CLK4
Hydrochloric Acid SCHEMBL30612948 0.89 TLR8 (0.36) TLR8CDK8CDK5ROCK1CLK4
Hydrochloric Acid SCHEMBL21712391 0.89 TLR8 (0.36) TLR8CDK8CDK5ROCK1CLK4
SCHEMBL30662199 0.86 TLR8 (0.45) TLR8CDK8CDK5ROCK1CLK4
SCHEMBL21712374 0.86 TLR8 (0.45) TLR8CDK8CDK5ROCK1CLK4
SCHEMBL21712361 0.85 NCF1 (0.39) TLR8CDK8CDK5ROCK1CLK4
SCHEMBL30662172 0.85 NCF1 (0.39) TLR8CDK8CDK5ROCK1CLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3615539-B1 2-AMINO-QUINOLINE DERIVATIVES BIRDIE BIOPHARMACEUTICALS INC (KY) 2023-08-09 EP claimed
US-11053240-B2 2-amino-quinoline derivatives BIRDIE BIOPHARMACEUTICALS, INC. (KY) 2021-07-06 US claimed
US-20200055851-A1 2-AMINO-QUINOLINE DERIVATIVES BIRDIE BIOPHARMACEUTICALS, INC. (KY) 2020-02-20 US claimed
CN-110637018-A 2-amino-quinoline derivatives 博笛生物科技有限公司 2019-12-31 CN claimed
US-11834448-B2 2-amino-quinoline derivatives BIRDIE BIOPHARMACEUTICALS, INC. (KY) 2023-12-05 US disclosed
US-11834448-B2 2-amino-quinoline derivatives BIRDIE BIOPHARMACEUTICALS, INC. (KY) 2023-12-05 US disclosed
US-11834448-B2 2-amino-quinoline derivatives BIRDIE BIOPHARMACEUTICALS, INC. (KY) 2023-12-05 US disclosed
EP-3615539-B1 2-AMINO-QUINOLINE DERIVATIVES BIRDIE BIOPHARMACEUTICALS INC (KY) 2023-08-09 EP disclosed
EP-3615539-B1 2-AMINO-QUINOLINE DERIVATIVES BIRDIE BIOPHARMACEUTICALS INC (KY) 2023-08-09 EP disclosed
US-11053240-B2 2-amino-quinoline derivatives BIRDIE BIOPHARMACEUTICALS, INC. (KY) 2021-07-06 US disclosed
US-11053240-B2 2-amino-quinoline derivatives BIRDIE BIOPHARMACEUTICALS, INC. (KY) 2021-07-06 US disclosed
US-20200055851-A1 2-AMINO-QUINOLINE DERIVATIVES BIRDIE BIOPHARMACEUTICALS, INC. (KY) 2020-02-20 US disclosed
US-20200055851-A1 2-AMINO-QUINOLINE DERIVATIVES BIRDIE BIOPHARMACEUTICALS, INC. (KY) 2020-02-20 US disclosed
CN-110637018-A 2-amino-quinoline derivatives 博笛生物科技有限公司 2019-12-31 CN 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 (3 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-11053240-B2 2-amino-quinoline derivatives TLR7, TLR8, TLR1 TLR8 2/4885CDK8 124/4885CDK5 3039/4885
US-20200055851-A1 2-AMINO-QUINOLINE DERIVATIVES TLR7, TLR8, TLR1 TLR8 2/4885CDK8 124/4885CDK5 3039/4885
US-11834448-B2 2-amino-quinoline derivatives TLR7, TLR8, TLR1 TLR8 2/4885CDK8 124/4885CDK5 3039/4885

“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.