SCHEMBL19983901

SCHEMBL19983901

CNCc1cn(Sc2cccc(OC)c2)c2cc(Nc3ccc(C)nc3Cl)ccc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
HTT P42858 1/20 0.35
POLB P06746 4/20 0.34
TP53 P04637 2/20 0.34
RXFP1 Q9HBX9 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
MAPT P10636 5/20 0.33
PSEN1 P49768 3/20 0.33
PSEN2 P49810 3/20 0.33
APH1B Q8WW43 3/20 0.33
NCSTN Q92542 3/20 0.33
APH1A Q96BI3 3/20 0.33
PSENEN Q9NZ42 3/20 0.33
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
JAK2 O60674 2/20 0.33
PTK2 Q05397 2/20 0.33
SLC2A1 P11166 1/20 0.32
SIRT2 Q8IXJ6 1/20 0.32
RAD52 P43351 1/20 0.31

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
SCHEMBL19983907 0.84 FPR1 (0.36) POLBTP53RXFP1SMN1; SMN2MAPT
SCHEMBL19983902 0.84 MTNR1A (0.33) POLBKMT2A
SCHEMBL19984027 0.84 MAPK14 (0.37) POLBMAPTKMT2AMEN1
SCHEMBL19984025 0.83 MAPK14 (0.32) TSHRHTTMAPT
SCHEMBL19984020 0.83 MTNR1A (0.33)
SCHEMBL19984271 0.82 HTR2A (0.34) POLBSMN1; SMN2MAPTKMT2AMEN1
SCHEMBL19984021 0.82 GAK (0.40) POLBKMT2AMEN1
SCHEMBL19983780 0.82 PLK4 (0.30)
SCHEMBL19983885 0.81 FBP1 (0.39)
SCHEMBL19983767 0.80

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