SCHEMBL22575729

SCHEMBL22575729

Cc1cc(-c2[nH]c3ccc(-c4ccnc(C5CCN(C(C)C)CC5)c4)cc3c2C(C)C)ccn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 20/20 1.00
TLR8 Q9NR97 20/20 1.00
TLR7 Q9NYK1 19/20 1.00

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
SCHEMBL30602069 1.00 TLR9 (1.00) TLR9TLR8TLR7
SCHEMBL22575630 0.94 TLR9 (1.00) TLR9TLR8TLR7
SCHEMBL30602183 0.94 TLR9 (1.00) TLR9TLR8TLR7
SCHEMBL29585479 0.87 TLR8 (1.00) TLR9TLR8TLR7
SCHEMBL19952377 0.87 TLR8 (1.00) TLR9TLR8TLR7
SCHEMBL22575920 0.85 TLR9 (0.75) TLR9TLR8TLR7
SCHEMBL30602188 0.85 TLR9 (0.75) TLR9TLR8TLR7
SCHEMBL22575526 0.83 TLR8 (1.00) TLR9TLR8TLR7
SCHEMBL30602013 0.83 TLR8 (1.00) TLR9TLR8TLR7
SCHEMBL19952256 0.83 TLR9 (1.00) TLR9TLR8TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111491918-B Aryl and heteroaryl substituted indole compounds 百时美施贵宝公司 2023-10-24 CN claimed
EP-3728188-B1 ARYL AND HETEROARYL SUBSTITUTED INDOLE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2023-10-11 EP claimed
US-11420958-B2 Aryl and heteroaryl substituted indole compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2022-08-23 US claimed
US-20210087174-A1 ARYL AND HETEROARYL SUBSTITUTED INDOLE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2021-03-25 US claimed
CN-111491918-A Aryl and heteroaryl substituted indole compounds 百时美施贵宝公司 2020-08-04 CN claimed
CN-111491918-B Aryl and heteroaryl substituted indole compounds 百时美施贵宝公司 2023-10-24 CN disclosed
EP-3728188-B1 ARYL AND HETEROARYL SUBSTITUTED INDOLE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2023-10-11 EP disclosed
EP-3728188-B1 ARYL AND HETEROARYL SUBSTITUTED INDOLE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2023-10-11 EP disclosed
US-11420958-B2 Aryl and heteroaryl substituted indole compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2022-08-23 US disclosed
US-20210087174-A1 ARYL AND HETEROARYL SUBSTITUTED INDOLE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2021-03-25 US disclosed
US-20210087174-A1 ARYL AND HETEROARYL SUBSTITUTED INDOLE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2021-03-25 US disclosed
EP-3728188-A1 ARYL AND HETEROARYL SUBSTITUTED INDOLE COMPOUNDS Bristol-Myers Squibb Company (US) 2020-10-28 EP disclosed
CN-111491918-A Aryl and heteroaryl substituted indole compounds 百时美施贵宝公司 2020-08-04 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 (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-20210087174-A1 ARYL AND HETEROARYL SUBSTITUTED INDOLE COMPOUNDS TLR7, TLR1, TLR9 TLR9 3/4885TLR8 4/4885TLR7 1/4885
US-11420958-B2 Aryl and heteroaryl substituted indole compounds TLR7, TLR1, TLR9 TLR9 3/4885TLR8 4/4885TLR7 1/4885

“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.