SCHEMBL19983977

SCHEMBL19983977

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

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 4/20 0.32
HTR2A P28223 2/20 0.32
KCNH2 Q12809 2/20 0.32
SLC6A2 P23975 2/20 0.31
SLC6A3 Q01959 2/20 0.31
USP2 O75604 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 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
SCHEMBL19984299 0.89 SLC6A4 (0.35) SLC6A4HTR2AKCNH2SLC6A2SLC6A3
SCHEMBL19983825 0.82 CARM1 (0.32) SLC6A4SLC6A2SLC6A3
SCHEMBL16618625 0.81 PDE4A (0.40) SLC6A4SLC6A2SLC6A3
SCHEMBL19984212 0.79 SLC6A4 (0.33) SLC6A4HTR2AKCNH2SLC6A2SLC6A3
SCHEMBL16619072 0.76 RORC (0.41) SLC6A4SLC6A2SLC6A3
SCHEMBL16618589 0.70 HTR6 (0.44) SLC6A4SLC6A2SLC6A3
SCHEMBL19984279 0.69 SLC6A4 (0.35) SLC6A4HTR2AKCNH2SLC6A2SLC6A3
SCHEMBL16626620 0.67 SLC6A2 (0.43) SLC6A4SLC6A2SLC6A3
SCHEMBL16619014 0.67 HTR6 (0.37) SLC6A4SLC6A2SLC6A3
SCHEMBL19983775 0.67 EGFR (0.34)

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