SCHEMBL19983978

SCHEMBL19983978

CNCc1cn(Sc2cccc(Cl)c2)c2cc(Cc3ccc(OC)nc3Cl)ccc12

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 2/20 0.35
MTNR1B P49286 2/20 0.35
SLC6A4 P31645 3/20 0.33
KCNH2 Q12809 2/20 0.33
HTR2A P28223 1/20 0.33
SLC6A2 P23975 2/20 0.31
SLC6A3 Q01959 2/20 0.31
LMNA P02545 1/20 0.31
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
KDR P35968 1/20 0.30
EPHB4 P54760 1/20 0.30
TEK Q02763 1/20 0.30
CYP2C9 P11712 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
SCHEMBL19984040 0.92 MTNR1A (0.34) MTNR1AMTNR1BSLC6A4KCNH2HTR2A
SCHEMBL19983971 0.89 PDE5A (0.33) MTNR1AMTNR1BSLC6A4KCNH2HTR2A
SCHEMBL19983902 0.85 MTNR1A (0.33) MTNR1AMTNR1BSLC6A4KCNH2SLC6A2
SCHEMBL16619196 0.80 HTR6 (0.43) MTNR1AMTNR1B
SCHEMBL19984020 0.77 MTNR1A (0.33) MTNR1AMTNR1B
SCHEMBL16619291 0.74 HTR6 (0.43)
SCHEMBL19983780 0.74 PLK4 (0.30)
SCHEMBL16626653 0.74 HTR6 (0.40) MTNR1AMTNR1BHTR2A
SCHEMBL19983936 0.73 TOP2A (0.32)
SCHEMBL19984208 0.73 SLC6A4 (0.34) SLC6A4KCNH2HTR2ASLC6A2SLC6A3

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