SCHEMBL19983904

SCHEMBL19983904

CNCc1c[nH]c2cc(Nc3ccc4ncccc4c3)ccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 1/20 0.45
AURKA O14965 3/20 0.42
EGFR P00533 1/20 0.41
NPC1 O15118 2/20 0.41
KDR P35968 4/20 0.41
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
ABCB1 P08183 1/20 0.40
ABCC1 P33527 1/20 0.40
ABCG2 Q9UNQ0 1/20 0.40
TGFBR1 P36897 1/20 0.39
STK10 O94804 1/20 0.38
SLK Q9H2G2 1/20 0.38
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
TERT O14746 2/20 0.38
PIK3CD O00329 1/20 0.37
PIK3CA P42336 1/20 0.37

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
SCHEMBL19983828 0.81 LMNA (0.38) GRM4NPC1MEN1MAPTKMT2A
SCHEMBL19983892 0.81 PTGS2 (0.46) GRM4KDRALDH1A1
SCHEMBL19983863 0.80 GPR84 (0.38) GRM4KDRALDH1A1
SCHEMBL19984142 0.80 BACE1 (0.39) GRM4
SCHEMBL19983890 0.80 EGFR (0.43) GRM4EGFRPOLBKMT2A
SCHEMBL19984015 0.80 GRM4 (0.39) GRM4
SCHEMBL19984195 0.78 LRRK2 (0.41) GRM4KDRMEN1KMT2AALDH1A1
SCHEMBL19983769 0.77 TRPV1 (0.44) GRM4
SCHEMBL19984000 0.76 HTR2A (0.46) MEN1MAPTKMT2AALDH1A1
SCHEMBL19984119 0.75 GPR84 (0.53)

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