SCHEMBL30995487

SCHEMBL30995487

CCCCCn1cc2ccc(Cl)cc2n1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 2/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ENPP2 Q13822 1/20 0.40
THRB P10828 1/20 0.39
ADORA3 P0DMS8 1/20 0.38
CRHR1 P34998 1/20 0.38
PDE4D Q08499 1/20 0.38
KDR P35968 5/20 0.38

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
SCHEMBL30995445 0.98 ENPP2 (0.42) TLR8MEN1KMT2AENPP2THRB
SCHEMBL30995439 0.95 KMT2A (0.46) TLR8MEN1KMT2ATHRBADORA3
SCHEMBL30995464 0.89 THRB (0.41) MEN1KMT2ATHRBADORA3CRHR1
SCHEMBL30995468 0.84 THRB (0.36) MEN1KMT2ATHRBPDE4D
SCHEMBL30995481 0.82 THRB (0.35) KMT2ATHRBPDE4D
SCHEMBL30995456 0.82 NOTUM (0.41) MEN1KMT2ATHRBADORA3
SCHEMBL30995500 0.80 MAP4K4 (0.43) KMT2ATHRBCRHR1
SCHEMBL30995440 0.79 THRB (0.36) KMT2ATHRBADORA3KDR
SCHEMBL254046 0.78 TLR8 (0.50) TLR8MEN1KMT2AKDR
SCHEMBL26024454 0.77 TLR8 (0.41) TLR8PDE4DKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118530224-A Pyrimidinone compound and application thereof 深圳安泰维生物医药有限公司 2024-08-23 CN disclosed