SCHEMBL19983988

SCHEMBL19983988

CNc1c[nH]c2cc(Nc3ccc(C)cc3Cl)ccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
MAPK8 P45983 3/20 0.36
MAPK10 P53779 3/20 0.36
MAPK14 Q16539 3/20 0.36
BCL6 P41182 4/20 0.36
BCOR Q6W2J9 4/20 0.36
STING1 Q86WV6 2/20 0.36
NR4A2 P43354 1/20 0.35
HTR2A P28223 1/20 0.34
FADS1 O60427 1/20 0.34
IMPDH2 P12268 1/20 0.33
HTT P42858 1/20 0.33
EGFR P00533 1/20 0.33
CAPN1 P07384 1/20 0.32
CTSL P07711 1/20 0.32
CTSB P07858 1/20 0.32
IDO1 P14902 1/20 0.32
TDO2 P48775 1/20 0.32
ASH1L Q9NR48 1/20 0.32
APP P05067 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
SCHEMBL19983715 0.83 HTR2A (0.42) MAPK8MAPK10MAPK14BCL6BCOR
SCHEMBL19984228 0.80 NR4A2 (0.46) POLBMAPK8MAPK10MAPK14BCL6
SCHEMBL14864247 0.73 GAA (0.48) POLBHTTEGFRAPP
SCHEMBL28375689 0.72 GPR84 (0.58) NR4A2HTR2AIDO1TDO2
SCHEMBL19983739 0.72 CHRNB2 (0.50) HTR2AEGFRIDO1
SCHEMBL18590733 0.71 HPGD (0.48) POLBHTTEGFRAPP
SCHEMBL5768693 0.71 RAB9A (0.47) POLBHTT
SCHEMBL19984030 0.69 GPR84 (0.48) MAPK14HTR2A
SCHEMBL19984005 0.69 HTR2A (0.44) HTR2A
SCHEMBL19984037 0.68 SLC6A2 (0.34) POLBHTT

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