SCHEMBL19984199

SCHEMBL19984199

CNCc1cn(Sc2cccnc2)c2cc(Nc3c(F)c(F)cc(F)c3F)ccc12

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAP3K8 P41279 3/20 0.31
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
PABPC1 P11940 1/20 0.30
KMT2A Q03164 1/20 0.30
MAPK13 O15264 1/20 0.30
EIF2AK2 P19525 1/20 0.30
MAPK12 P53778 1/20 0.30
MAPK11 Q15759 1/20 0.30
MAPK14 Q16539 1/20 0.30
HTR2C P28335 1/20 0.30
EGFR P00533 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
SCHEMBL19983848 0.92 MAP3K8 (0.32) MAP3K8MEN1MAPTPABPC1KMT2A
SCHEMBL19983721 0.87 HTR2C (0.32) MEN1MAPTPABPC1KMT2AHTR2C
SCHEMBL19984011 0.86 EGFR (0.34) MAP3K8MEN1MAPTKMT2AEGFR
SCHEMBL19984241 0.86 RAPGEF4 (0.32) HTR2C
SCHEMBL19983826 0.86 ABCG2 (0.37) KMT2AHTR2C
SCHEMBL19984177 0.85 HTR2C (0.39) KMT2AHTR2C
SCHEMBL19984087 0.85 SLC6A2 (0.34) MAP3K8MAPK13EIF2AK2MAPK12MAPK11
SCHEMBL19984127 0.84 NUDT1 (0.36) MAP3K8EGFR
SCHEMBL19983879 0.84
SCHEMBL19983874 0.84 CYP19A1 (0.33)

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