SCHEMBL19984223

SCHEMBL19984223

CNCc1cn(Sc2cccnc2)c2cc(Nc3ccc(OC)c(F)c3F)ccc12

nearest known ligand 0.32

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
CSF1R P07333 1/20 0.32
KIT P10721 1/20 0.32
NAMPT P43490 3/20 0.31
JAK2 O60674 1/20 0.31
PTK2 Q05397 1/20 0.31
ABCB1 P08183 1/20 0.31
ABCG2 Q9UNQ0 1/20 0.31
PDE4B Q07343 1/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
CHEK1 O14757 1/20 0.31
CYP3A4 P08684 2/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C19 P33261 1/20 0.30
CYP17A1 P05093 1/20 0.30
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 1/20 0.30

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
SCHEMBL19983874 0.89 CYP19A1 (0.33)
SCHEMBL19983844 0.87 ALDH1A1 (0.35) CSF1RKITNAMPTJAK2PTK2
SCHEMBL19983840 0.85 LRRK2 (0.36) NAMPTJAK2PTK2
SCHEMBL19983743 0.85 SRC (0.40) SLC6A2SLC6A4KIT
SCHEMBL19984203 0.85 ABL1 (0.35) KITNAMPT
SCHEMBL19983721 0.84 HTR2C (0.32) NAMPT
SCHEMBL19984171 0.83 POLB (0.37) SLC6A2NAMPT
SCHEMBL19984127 0.83 NUDT1 (0.36) SLC6A2SLC6A4CYP1A2CYP2C19CYP11B1
SCHEMBL19983981 0.83 CNR2 (0.34) JAK2PTK2CYP3A4CYP1A2CYP2C19
SCHEMBL19984199 0.83 MAP3K8 (0.31)

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-3052484-B1 SULFONYLINDOLE DERIVATIVES AND METHOD FOR PREPARING THE SAME DAE WOONG PHARMA (KR) 2018-03-21 EP disclosed