SCHEMBL8555862

SCHEMBL8555862

Cc1nn(-c2ccccc2)c(NC(=O)NS(=O)(=O)c2ccc(Br)cc2)c1C#N

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 1/20 0.48
POLB P06746 1/20 0.46
HTT P42858 1/20 0.46
MAPT P10636 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
ALDH1A1 P00352 1/20 0.46
FPR1 P21462 8/20 0.45
SLCO1B1 Q9Y6L6 1/20 0.42
LMNA P02545 1/20 0.42
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
GAA P10253 1/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
KDM4E B2RXH2 2/20 0.39
USP2 O75604 1/20 0.39
TSHR P16473 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
SCHEMBL8550650 0.92 FPR1 (0.53) NTRK1POLBHTTKMT2AALDH1A1
SCHEMBL1984012 0.90 NTRK1 (0.48) NTRK1POLBHTTMAPTALDH1A1
SCHEMBL8552895 0.88 FPR1 (0.48) NTRK1POLBHTTMAPTALDH1A1
SCHEMBL8551653 0.84 NTRK1 (0.53) NTRK1POLBHTTMAPTALDH1A1
SCHEMBL8557247 0.84 NTRK1 (0.51) NTRK1POLBHTTMAPTALDH1A1
SCHEMBL8553012 0.81 LMNA (0.49) POLBMAPTMEN1KMT2AALDH1A1
SCHEMBL8556018 0.80 LMNA (0.48) NTRK1KMT2AALDH1A1FPR1SLCO1B1
SCHEMBL8555343 0.80 FPR1 (0.50) NTRK1KMT2AALDH1A1FPR1SLCO1B1
SCHEMBL8555845 0.80 LMNA (0.47) NTRK1KMT2AALDH1A1FPR1SLCO1B1
SCHEMBL8555582 0.80 LMNA (0.47) NTRK1MAPTKMT2AALDH1A1FPR1

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