SCHEMBL13401052

SCHEMBL13401052

CCCCc1nnc(S)n1-c1ccc(F)cc1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 3/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ ADORA3 P0DMS8 3/20 0.36
▸ HSD17B10 Q99714 1/20 0.34
▸ GCGR P47871 1/20 0.34
▸ VCP P55072 1/20 0.34
▸ ESR1 P03372 1/20 0.34
▸ ESR2 Q92731 1/20 0.34
▸ ADORA2B P29275 1/20 0.34
▸ ADORA1 P30542 1/20 0.34
▸ HKDC1 Q2TB90 1/20 0.34
▸ ADORA2A P29274 1/20 0.34
▸ UCHL3 P15374 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ PDE4A P27815 1/20 0.33
▸ PDE4B Q07343 1/20 0.33
▸ PDE4C Q08493 1/20 0.33
▸ PDE4D Q08499 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
SCHEMBL13401051 0.84 CETP (0.47) LMNAMAPK1VCPPDE4APDE4B
SCHEMBL2985804 0.80 CETP (0.52) LMNAMAPK1VCP
SCHEMBL2984817 0.79 CETP (0.55) LMNAMAPK1VCP
SCHEMBL3125038 0.79 CETP (0.55) LMNAMAPK1VCP
SCHEMBL17153858 0.79 CETP (0.55) LMNAMAPK1VCP
SCHEMBL564057 0.79 CETP (0.55) LMNAMAPK1VCP
Methyl Alcohol SCHEMBL4850107 0.77 CETP (0.52) LMNAMAPK1VCP
SCHEMBL11512514 0.76 CACNA2D1 (0.52) TLR8LMNA
SCHEMBL10012448 0.74 VCP (0.44) TLR8VCP
SCHEMBL11391926 0.73 KMT2A (0.49) TLR8LMNAHSD17B10

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
US-7695888-B2 Photosensitive lithographic printing plate FUJIFILM CORPORATION (JP) 2010-04-13 — — US disclosed
US-7695888-B2 Photosensitive lithographic printing plate FUJIFILM CORPORATION (JP) 2010-04-13 — — US disclosed
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