SCHEMBL19984241

SCHEMBL19984241

CNCc1cn(Sc2cccnc2)c2cc(Nc3c(C)cc(C)cc3C)ccc12

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 13/20 0.32
LCK P06239 1/20 0.31
ALDH1A1 P00352 3/20 0.31
HTR2C P28335 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL19983703 0.87 LCK (0.37) LCK
SCHEMBL19983848 0.87 MAP3K8 (0.32) HTR2C
SCHEMBL19984177 0.86 HTR2C (0.39) ALDH1A1HTR2C
SCHEMBL19984199 0.86 MAP3K8 (0.31) HTR2C
SCHEMBL19984087 0.86 SLC6A2 (0.34) HTR2C
SCHEMBL19983826 0.83 ABCG2 (0.37) LCKHTR2C
SCHEMBL19983727 0.83 ABL1 (0.36) ALDH1A1HTR2C
SCHEMBL19983893 0.82 HTR2C (0.32) HTR2C
SCHEMBL19983883 0.82 HTR2C (0.32) HTR2C
SCHEMBL19983721 0.82 HTR2C (0.32) LCKHTR2C

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