SCHEMBL10345341

SCHEMBL10345341

CCOC(=O)C1=Cc2cc(C3=CCN(C(=O)N4CCCC4)CC3)ccc2N=C(N)C1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 9/20 0.45
▸ TLR7 Q9NYK1 3/20 0.45
▸ KCNH2 Q12809 1/20 0.36
▸ HRH3 Q9Y5N1 1/20 0.36
▸ QDPR P09417 2/20 0.35
▸ KIT P10721 1/20 0.34
▸ HPGD P15428 2/20 0.34
▸ KHK P50053 1/20 0.34
▸ CCNT1 O60563 1/20 0.34
▸ CDK9 P50750 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ TSHR P16473 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ LMNA P02545 1/20 0.34

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
SCHEMBL10345316 0.91 TLR8 (0.48) TLR8TLR7QDPRKITHPGD
SCHEMBL15496639 0.90 TLR8 (0.47) TLR8TLR7QDPRHPGDALDH1A1
SCHEMBL10325097 0.80 TLR8 (0.63) TLR8TLR7HPGD
SCHEMBL19265665 0.80 TLR8 (0.37) TLR8TLR7QDPRKITHPGD
SCHEMBL19265582 0.79 TLR8 (0.52) TLR8TLR7ALDH1A1
SCHEMBL10345315 0.78 TLR8 (0.52) TLR8TLR7QDPRCCNT1CDK9
SCHEMBL10325490 0.78 TLR8 (0.59) TLR8TLR7
SCHEMBL10325134 0.77 TLR8 (0.53) TLR8TLR7HPGD
SCHEMBL15496644 0.76 TLR8 (0.64) TLR8TLR7
SCHEMBL10345313 0.75 TLR8 (0.67) TLR8TLR7HPGDALDH1A1MEN1

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
EP-3208263-A1 SUBSTITUTED BENZOAZEPINES AS TOLL-LIKE RECEPTOR MODULATORS VentiRx Pharmaceuticals, Inc. (US) 2017-08-23 — — EP disclosed
US-9718796-B2 Substituted benzoazepines as toll-like receptor modulators VENTIRX PHARMACEUTICALS, INC. (US) 2017-08-01 — — US disclosed
US-9718796-B2 Substituted benzoazepines as toll-like receptor modulators VENTIRX PHARMACEUTICALS, INC. (US) 2017-08-01 — — US disclosed
US-20140066432-A1 Substituted Benzoazepines As Toll-Like Receptor Modulators VENTIRX PHARMACEUTICALS, INC. 2014-03-06 — — US disclosed
US-20140066432-A1 Substituted Benzoazepines As Toll-Like Receptor Modulators VENTIRX PHARMACEUTICALS, INC. 2014-03-06 — — US disclosed
WO-2012097173-A2 SUBSTITUTED BENZOAZEPINES AS TOLL-LIKE RECEPTOR MODULATORS VENTIRX PHARMACEUTICALS, INC. (US) 2012-07-19 — — WO 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 (1 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-20140066432-A1 Substituted Benzoazepines As Toll-Like Receptor Modulators TLR8, TLR9, TLR1 TLR8 1/4885TLR7 4/4885KCNH2 1511/4885

“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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