SCHEMBL9492907

SCHEMBL9492907

C=CCc1cc(N)n(CCCCC)n1

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 2/20 0.35
KDR P35968 4/20 0.33
MPO P05164 1/20 0.33

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
SCHEMBL9628160 0.83 CNR1 (0.34) MPO
SCHEMBL4796197 0.77 CNR1 (0.42)
SCHEMBL27821973 0.75 NOS2 (0.43) MPO
SCHEMBL6128069 0.75 POLB (0.47) TLR8
SCHEMBL11688903 0.73 POLB (0.46) TLR8KDR
SCHEMBL23709236 0.72 KDR (0.38) TLR8KDRMPO
SCHEMBL284028 0.71 CNR1 (0.55) TLR8
SCHEMBL10625859 0.70 CNR1 (0.41) TLR8
SCHEMBL10707345 0.70 NPC1 (0.38) TLR8KDRMPO
SCHEMBL2791515 0.70 KDM4E (0.36) TLR8KDRMPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0320750-B1 PROCESS FOR THE PREPARATION OF 4-SUBSTITUTED-3-METHYL-1-ARYL-5-AMINO-PYRAZOLES BAYER AG (DE) 1993-02-03 EP disclosed
US-4895957-A Process for the preparation of 4-substituted 3-methyl-1-aryl-5-amino-pyrazoles BAYER AKTIENGESELLSCHAFT (DE) 1990-01-23 US disclosed
EP-0320750-A2 Process for the preparation of 4-substituted-3-methyl-1-aryl-5-amino-pyrazoles BAYER AG (DE) 1989-06-21 EP disclosed