SCHEMBL8552811

SCHEMBL8552811

CCCCc1nn(-c2ccccc2)c(NC(=O)NS(=O)(=O)c2ccc(C)cc2)c1C#N

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FPR1 P21462 10/20 0.45
LMNA P02545 3/20 0.45
ALDH1A1 P00352 1/20 0.43
ALB P02768 1/20 0.43
CYP2C9 P11712 1/20 0.43
TSHR P16473 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
GAA P10253 1/20 0.43
SLCO1B1 Q9Y6L6 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 1/20 0.39
NTRK1 P04629 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
SCHEMBL8556018 0.91 LMNA (0.48) FPR1LMNAALDH1A1GAASLCO1B1
SCHEMBL8555845 0.88 LMNA (0.47) FPR1LMNAALDH1A1GAASLCO1B1
SCHEMBL8555582 0.88 LMNA (0.47) FPR1LMNAALDH1A1GAASLCO1B1
SCHEMBL8552919 0.88 FPR1 (0.44) FPR1LMNAGAASLCO1B1L3MBTL1
SCHEMBL8553171 0.88 NTRK1 (0.41) FPR1GAAKDM4ENTRK1
SCHEMBL8550650 0.85 FPR1 (0.53) FPR1LMNAALDH1A1GAASLCO1B1
SCHEMBL8554369 0.83 GAA (0.46) FPR1LMNAALDH1A1TSHRGAA
SCHEMBL8553012 0.82 LMNA (0.49) FPR1LMNAALDH1A1CYP2C9GAA
SCHEMBL8556673 0.82 PTGES (0.40) LMNAALDH1A1TSHRL3MBTL1KMT2A
SCHEMBL8555343 0.81 FPR1 (0.50) FPR1LMNAALDH1A1GAASLCO1B1

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
EP-0885890-A1 SULFONYLUREIDOPYRAZOLE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-12-23 EP claimed
EP-0885890-A1 SULFONYLUREIDOPYRAZOLE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-12-23 EP disclosed