SCHEMBL19984203

SCHEMBL19984203

CNCc1cn(Sc2cccnc2)c2cc(Nc3ccc(OC(F)(F)F)cc3OC)ccc12

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.35
P2RX7 Q99572 6/20 0.35
KDR P35968 1/20 0.34
MAT2A P31153 1/20 0.33
NAMPT P43490 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
BCR P11274 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
MKNK2 Q9HBH9 1/20 0.32
POLB P06746 1/20 0.32
DGAT2 Q96PD7 1/20 0.32
KIT P10721 1/20 0.32

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
SCHEMBL19984007 0.91 MAT2A (0.34) ABL1P2RX7KDRMAT2ABCR
SCHEMBL19983791 0.87 KDR (0.33) P2RX7KDRMAPT
SCHEMBL19984009 0.87 ALPL (0.37) KDRNAMPT
SCHEMBL19983981 0.86 CNR2 (0.34) KDRALDH1A1MEN1KMT2ADGAT2
SCHEMBL19983844 0.85 ALDH1A1 (0.35) NAMPTALDH1A1MAPTMEN1KMT2A
SCHEMBL19984223 0.85 SLC6A2 (0.32) NAMPTKIT
SCHEMBL19983915 0.83 MKNK2 (0.35) P2RX7MKNK2
SCHEMBL19983840 0.82 LRRK2 (0.36) NAMPT
SCHEMBL16626439 0.82 LMNA (0.39) ABL1P2RX7KDRNAMPTSMN1; SMN2
SCHEMBL19983743 0.82 SRC (0.40) KDRKIT

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