SCHEMBL19983933

SCHEMBL19983933

CNCc1cn(Sc2ccc(F)c(F)c2)c2cc(Nc3ccc(C)cc3F)ccc12

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
IDO1 P14902 1/20 0.31
APP P05067 1/20 0.30
RAPGEF4 Q8WZA2 1/20 0.30
MAP2K2 P36507 1/20 0.30
MAP2K1 Q02750 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
SCHEMBL19983954 0.90 HTR2A (0.32) KDM4E
SCHEMBL19983888 0.89 P2RX7 (0.31) KDM4E
SCHEMBL19983916 0.85 KDM4E (0.30) KDM4E
SCHEMBL19984027 0.79 MAPK14 (0.37)
SCHEMBL19984279 0.78 SLC6A4 (0.35)
SCHEMBL19983907 0.78 FPR1 (0.36) IDO1
SCHEMBL19983937 0.78 MPO (0.37) KDM4EIDO1APP
SCHEMBL16626527 0.77 HTR6 (0.42)
Hydrochloric Acid SCHEMBL16619067 0.77 HTR6 (0.42)
SCHEMBL19984127 0.77 NUDT1 (0.36)

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