SCHEMBL19983954

SCHEMBL19983954

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

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 4/20 0.32
SLC6A4 P31645 4/20 0.32
KCNH2 Q12809 4/20 0.32
KDM4E B2RXH2 1/20 0.31
P2RX7 Q99572 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
SCHEMBL19983933 0.90 KDM4E (0.32) KDM4E
SCHEMBL19983888 0.88 P2RX7 (0.31) SLC6A4KCNH2KDM4EP2RX7
SCHEMBL19983916 0.83 KDM4E (0.30) KDM4E
SCHEMBL19984279 0.81 SLC6A4 (0.35) HTR2ASLC6A4KCNH2
SCHEMBL19984029 0.79 APP (0.35) HTR2ASLC6A4KCNH2
SCHEMBL16626618 0.79 HTR6 (0.44) HTR2ASLC6A4KCNH2KDM4E
Hydrochloric Acid SCHEMBL16619535 0.78 HTR6 (0.43) HTR2ASLC6A4KCNH2KDM4E
SCHEMBL19983907 0.77 FPR1 (0.36) HTR2ASLC6A4KCNH2
SCHEMBL19983937 0.77 MPO (0.37) HTR2ASLC6A4KCNH2KDM4E
SCHEMBL19983775 0.77 EGFR (0.34) P2RX7

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