SCHEMBL19983883

SCHEMBL19983883

CNCc1cn(Sc2cccnc2)c2cc(Nc3cc(Cl)c(Cl)cc3Cl)ccc12

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.32
BCL6 P41182 3/20 0.31
BCOR Q6W2J9 1/20 0.31
FLT1 P17948 1/20 0.30
EPHA2 P29317 1/20 0.30
KDR P35968 1/20 0.30
EPHB4 P54760 1/20 0.30
P2RX7 Q99572 1/20 0.30
EGFR P00533 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 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
SCHEMBL19983743 0.91 SRC (0.40) FLT1EPHA2KDREPHB4SLC6A2
SCHEMBL19983733 0.91 SLC6A2 (0.37) HTR2CFLT1P2RX7SLC6A2SLC6A4
SCHEMBL19984171 0.89 POLB (0.37) HTR2CBCL6P2RX7EGFRSLC6A2
SCHEMBL19983850 0.88 LRRK2 (0.40) BCL6SLC6A4
SCHEMBL19984087 0.87 SLC6A2 (0.34) HTR2CEGFRSLC6A2SLC6A4
SCHEMBL19983727 0.86 ABL1 (0.36) HTR2CSLC6A2SLC6A4
SCHEMBL19984127 0.86 NUDT1 (0.36) FLT1KDREGFRSLC6A2SLC6A4
SCHEMBL19983736 0.86 MAPT (0.38) BCL6BCOR
SCHEMBL19984177 0.85 HTR2C (0.39) HTR2C
SCHEMBL19983721 0.85 HTR2C (0.32) HTR2C

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