SCHEMBL30345730

SCHEMBL30345730

COCCc1nc2c(N)nc3ccccc3c2[nH]1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 12/20 0.42
TLR8 Q9NR97 9/20 0.40
NCF1 P14598 1/20 0.40
ADORA3 P0DMS8 1/20 0.38
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
PARP1 P09874 1/20 0.37
CACNA1H O95180 1/20 0.36

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
SCHEMBL24414995 1.00 TLR7 (0.42) TLR7TLR8NCF1ADORA3ADORA2A
SCHEMBL20968317 0.92 PARP1 (0.41) TLR7TLR8NCF1PARP1
SCHEMBL20968326 0.91 TLR7 (0.41) TLR7TLR8NCF1PARP1
SCHEMBL18268482 0.86 TLR7 (0.41) TLR7TLR8ADORA3ADORA2AADORA1
SCHEMBL9036182 0.85 TLR7 (0.52) TLR7TLR8ADORA3ADORA2AADORA1
SCHEMBL9038851 0.83 PARP1 (0.57) TLR7TLR8PARP1
SCHEMBL8600371 0.82 TNKS2 (0.53) TLR7TLR8ADORA3ADORA2AADORA1
SCHEMBL19475356 0.80 RAD52 (0.43) TLR7TLR8PARP1
SCHEMBL20968264 0.80 TP53 (0.42) TLR7PARP1
SCHEMBL20968370 0.80 TERT (0.44) TLR7TLR8NCF1PARP1

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-4419112-A1 IMMUNOTHERAPIES FOR THE TREATMENT OF CANCER Ohio State Innovation Foundation (US) 2024-08-28 EP disclosed
WO-2023070132-A1 IMMUNOTHERAPIES FOR THE TREATMENT OF CANCER OHIO STATE INNOVATION FOUNDATION (US) 2023-04-27 WO disclosed