SCHEMBL22347140

SCHEMBL22347140

CCCCOc1nc(N)c2ncn(Cc3ccc(CCN)cc3)c2n1

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 12/20 0.50
CYP3A4 P08684 3/20 0.45
ADORA2A P29274 1/20 0.45
ADORA2B P29275 1/20 0.45
CYP2D6 P10635 1/20 0.45

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
SCHEMBL30503503 1.00 TLR7 (0.50) TLR7CYP3A4ADORA2AADORA2BCYP2D6
SCHEMBL2060324 0.88 TLR7 (0.51) TLR7CYP3A4ADORA2AADORA2B
SCHEMBL7204649 0.87 TLR7 (0.64) TLR7ADORA2A
SCHEMBL4129389 0.85 TLR7 (0.48) TLR7CYP3A4CYP2D6
SCHEMBL7211348 0.84 TLR7 (0.60) TLR7ADORA2A
SCHEMBL23422260 0.84 TLR7 (0.48) TLR7CYP3A4ADORA2A
SCHEMBL24366542 0.84 TLR7 (0.62) TLR7
SCHEMBL2060294 0.83 ALDH1A1 (0.47) TLR7CYP3A4ADORA2AADORA2B
SCHEMBL25511867 0.83 MEN1 (0.51) TLR7ADORA2A
SCHEMBL4133313 0.83 TLR7 (0.57) TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116457023-A antibody-TLR agonist conjugates, methods and uses thereof AMBRX公司 2023-07-18 CN disclosed
EP-3923991-A1 COMPOSITIONS CONTAINING, METHODS AND USES OF ANTIBODY-TLR AGONIST CONJUGATES Ambrx, Inc. (US) 2021-12-22 EP disclosed
CN-113660957-A Compositions, methods, and uses comprising antibody-TLR agonist conjugates AMBRX公司 2021-11-16 CN disclosed
WO-2020168017-A1 COMPOSITIONS CONTAINING, METHODS AND USES OF ANTIBODY-TLR AGONIST CONJUGATES AMBRX, INC. (US) 2020-08-20 WO disclosed