SCHEMBL29601165

SCHEMBL29601165

CCCCNc1nc(F)nc2ncn(C(C)=O)c12

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 11/20 0.40
▸ TLR7 Q9NYK1 12/20 0.38
▸ POLB P06746 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ CYP2C9 P11712 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
SCHEMBL29601196 0.86 HDAC1 (0.43) TLR8TLR7POLBL3MBTL1CYP2C9
SCHEMBL29601395 0.80 HDAC1 (0.43) —
SCHEMBL29601423 0.77 ALDH1A1 (0.36) POLB
SCHEMBL29601224 0.69 HDAC1 (0.58) —
SCHEMBL29601461 0.68 SQOR (0.34) POLBL3MBTL1
SCHEMBL29601167 0.64 ALDH1A1 (0.36) POLB
SCHEMBL29601499 0.64 GAA (0.35) L3MBTL1CYP2C9
SCHEMBL24846612 0.63 CYP1A2 (0.62) —
SCHEMBL29601247 0.62 SLC29A1 (0.39) POLB
SCHEMBL16513142 0.62 CTSL (0.53) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3997089-A1 CYSTEINE BINDING COMPOSITIONS AND METHODS OF USE THEREOF University Of Virginia Patent Foundation (US) 2022-05-18 — — EP claimed
EP-3997089-A1 CYSTEINE BINDING COMPOSITIONS AND METHODS OF USE THEREOF University Of Virginia Patent Foundation (US) 2022-05-18 — — EP disclosed
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