SCHEMBL19935595

SCHEMBL19935595

CCCC[C@H](CNC(C)=O)Nc1nc(Cl)nc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 2/20 0.54
▸ TLR7 Q9NYK1 1/20 0.54
▸ KCNH2 Q12809 7/20 0.53
▸ ALDH1A1 P00352 4/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ APP P05067 2/20 0.41
▸ PDE5A O76074 1/20 0.41
▸ TACR3 P29371 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ KMT2A Q03164 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
SCHEMBL19924270 0.87 TLR8 (0.72) TLR8TLR7KCNH2APP
SCHEMBL19924271 0.87 TLR8 (0.72) TLR8TLR7KCNH2APP
SCHEMBL30076157 0.87 TLR8 (0.72) TLR8TLR7KCNH2APP
SCHEMBL19935525 0.85 KCNH2 (0.56) TLR8TLR7KCNH2CYP2D6LMNA
SCHEMBL30076081 0.83 KCNH2 (0.41) TLR8TLR7KCNH2ALDH1A1
SCHEMBL19924286 0.83 KCNH2 (0.41) TLR8TLR7KCNH2ALDH1A1
SCHEMBL19924288 0.83 KCNH2 (0.41) TLR8TLR7KCNH2ALDH1A1
SCHEMBL19924210 0.81 PDE4A (0.39) TLR8TLR7ALDH1A1
SCHEMBL19924213 0.81 PDE4A (0.39) TLR8TLR7ALDH1A1
SCHEMBL19998638 0.76 KCNH2 (0.39) TLR8TLR7KCNH2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11827609-B2 Toll like receptor modulator compounds GILEAD SCIENCES, INC. (US) 2023-11-28 — — US disclosed
EP-3507276-B1 TOLL LIKE RECEPTOR MODULATOR COMPOUNDS GILEAD SCIENCES INC (US) 2021-11-03 — — EP disclosed
US-11124487-B2 Toll like receptor modulator compounds GILEAD SCIENCES, INC. (US) 2021-09-21 — — US disclosed
US-10370342-B2 Toll like receptor modulator compounds GILEAD SCIENCES, INC. (US) 2019-08-06 — — US disclosed
WO-2018045144-A1 TOLL LIKE RECEPTOR MODULATOR COMPOUNDS GILEAD SCIENCES, INC. (US) 2018-03-08 — — WO disclosed
US-20180065938-A1 TOLL LIKE RECEPTOR MODULATOR COMPOUNDS GILEAD SCIENCES, INC. 2018-03-08 — — 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 (4 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-10370342-B2 Toll like receptor modulator compounds TLR8, TLR3, TLR6 TLR8 1/4885TLR7 9/4885KCNH2 4399/4885
US-11124487-B2 Toll like receptor modulator compounds TLR8, TLR3, TLR6 TLR8 1/4885TLR7 9/4885KCNH2 4399/4885
US-20180065938-A1 TOLL LIKE RECEPTOR MODULATOR COMPOUNDS TLR8, TLR3, TLR6 TLR8 1/4885TLR7 9/4885KCNH2 4399/4885
US-11827609-B2 Toll like receptor modulator compounds TLR8, TLR3, TLR6 TLR8 1/4885TLR7 9/4885KCNH2 4399/4885

“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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