SCHEMBL11048748

SCHEMBL11048748

Cc1cccc(-c2c[nH]c(CO)n2)c1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NUDT1 P36639 5/20 0.38
TLR8 Q9NR97 1/20 0.36
CTSA P10619 1/20 0.34
CD274 Q9NZQ7 2/20 0.33
CNR2 P34972 1/20 0.33
PDCD1 Q15116 1/20 0.33
AR P10275 2/20 0.33
TRPA1 O75762 1/20 0.32
ATM Q13315 1/20 0.32
CDC7 O00311 1/20 0.32
PLK4 O00444 1/20 0.32
MAPK13 O15264 1/20 0.32
PDPK1 O15530 1/20 0.32
DAPK3 O43293 1/20 0.32
DYRK3 O43781 1/20 0.32
JAK2 O60674 1/20 0.32
ROCK2 O75116 1/20 0.32
PRKD3 O94806 1/20 0.32
MAP4K4 O95819 1/20 0.32
PRKCG P05129 1/20 0.32

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
SCHEMBL11046400 0.87 IDO1 (0.41) TLR8ARATMCYP1A2CYP3A4
SCHEMBL11047777 0.82 HTR7 (0.38) TLR8AR
SCHEMBL11047513 0.75 ALPL (0.42) TLR8CTSAATMFGFR1
SCHEMBL11045846 0.75 TRPA1 (0.38) TLR8CD274PDCD1TRPA1CDK1
SCHEMBL11046550 0.74 METAP2 (0.45)
SCHEMBL11047726 0.73 IDO1 (0.45)
SCHEMBL8744801 0.72 NUDT1 (0.38) NUDT1TLR8CNR2ARTSHR
SCHEMBL7142089 0.72 TNKS (0.39) NUDT1CTSACD274PDCD1AR
SCHEMBL11049642 0.71 ALPL (0.42) TP53
SCHEMBL11047835 0.70 METAP2 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0024829-B1 4-BENZYL- AND 4-BENZOYLIMIDAZOLE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME Farmos-Yhtyma Oy (FI) 1984-04-25 EP claimed
US-4443466-A DIURETICS, SEDATIVES, ANALGESICS Farmos-Yhtyma OY (Farmos Group Ltd.) (FI) 1984-04-17 US claimed
EP-0024829-A1 4-Benzyl- and 4-benzoylimidazole derivatives, processes for their preparation and pharmaceutical compositions comprising the same Farmos-Yhtyma Oy (FI) 1981-03-11 EP claimed
EP-0024829-B1 4-BENZYL- AND 4-BENZOYLIMIDAZOLE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME Farmos-Yhtyma Oy (FI) 1984-04-25 EP disclosed
US-4443466-A DIURETICS, SEDATIVES, ANALGESICS Farmos-Yhtyma OY (Farmos Group Ltd.) (FI) 1984-04-17 US disclosed
EP-0024829-A1 4-Benzyl- and 4-benzoylimidazole derivatives, processes for their preparation and pharmaceutical compositions comprising the same Farmos-Yhtyma Oy (FI) 1981-03-11 EP disclosed