SCHEMBL6018886

SCHEMBL6018886

CSc1nc2c(C)cc(C)nc2n1-c1ccc(CCOC(=O)NS(=O)(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.45
AGTR1 P30556 8/20 0.42
AGTR2 P50052 6/20 0.42
TP53 P04637 2/20 0.39
KMT2A Q03164 2/20 0.39
MAPT P10636 2/20 0.39
MEN1 O00255 1/20 0.39
GMNN O75496 1/20 0.39
USP2 O75604 1/20 0.39
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
TSHR P16473 1/20 0.39
NFKB1 P19838 1/20 0.39
APEX1 P27695 1/20 0.39
CYP2C19 P33261 1/20 0.39
THPO P40225 1/20 0.39
MTOR P42345 1/20 0.39

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
SCHEMBL692034 0.88 PTGER4 (0.46) PTGER4AGTR1AGTR2TP53KMT2A
SCHEMBL6017951 0.87 PTGER4 (0.46) PTGER4AGTR1AGTR2TP53KMT2A
SCHEMBL6018899 0.87 PTGER4 (0.46) PTGER4AGTR1AGTR2TP53KMT2A
SCHEMBL1626267 0.86 PTGER4 (0.61) PTGER4TP53MAPTLMNACYP2C9
SCHEMBL1625803 0.79 PTGER4 (0.39) PTGER4TP53MAPTPOLB
SCHEMBL1625349 0.77 PTGER4 (0.65) PTGER4TP53MAPTLMNACYP2C9
SCHEMBL691760 0.76 PTGER4 (0.75) PTGER4AGTR1AGTR2TP53KMT2A
SCHEMBL30114805 0.76 PTGER4 (0.75) PTGER4AGTR1AGTR2TP53KMT2A
SCHEMBL691506 0.75 PTGER4 (0.59) PTGER4AGTR1AGTR2TP53KMT2A
SCHEMBL30114829 0.75 PTGER4 (0.59) PTGER4AGTR1AGTR2TP53KMT2A

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
EP-1666480-A1 Aryl or Heteroaryl Fused Imidazole Compounds as intermediates for Anti-Inflammatory And Analgesic Agents. PFIZER PHARMACEUTICALS INC. (JP) 2006-06-07 EP disclosed