SCHEMBL19984299

SCHEMBL19984299

CNCc1cn(Sc2ccc(OC)cc2)c2cc(Cc3ccc(C)cc3Cl)ccc12

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 7/20 0.35
HTR2A P28223 4/20 0.35
KCNH2 Q12809 3/20 0.35
TP53 P04637 2/20 0.35
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
KMT2A Q03164 1/20 0.34
YWHAH Q04917 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
SLC6A2 P23975 3/20 0.33
SLC6A3 Q01959 3/20 0.33
MAPT P10636 1/20 0.32
CHRM1 P11229 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
SCHEMBL19983977 0.89 SLC6A4 (0.32) SLC6A4HTR2AKCNH2POLBSLC6A2
SCHEMBL19983825 0.82 CARM1 (0.32) SLC6A4SLC6A2SLC6A3
SCHEMBL19984212 0.80 SLC6A4 (0.33) SLC6A4HTR2AKCNH2TP53SLC6A2
SCHEMBL16618589 0.80 HTR6 (0.44) SLC6A4SLC6A2SLC6A3
SCHEMBL19984040 0.75 MTNR1A (0.34) SLC6A4HTR2AKCNH2MEN1KMT2A
SCHEMBL16618630 0.74 HTR6 (0.45) SLC6A4SLC6A2SLC6A3MAPT
SCHEMBL19984031 0.72 ALDH1A1 (0.38) POLBMAPT
SCHEMBL19983978 0.72 MTNR1A (0.35) SLC6A4HTR2AKCNH2SLC6A2SLC6A3
SCHEMBL19984279 0.70 SLC6A4 (0.35) SLC6A4HTR2AKCNH2SLC6A2SLC6A3
SCHEMBL16618625 0.70 PDE4A (0.40) SLC6A4SLC6A2SLC6A3

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