SCHEMBL19983797

SCHEMBL19983797

CNCc1c[nH]c2cc(CC3=CC=C(OC)NC3Cl)ccc12

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HTR2A P28223 4/20 0.34
CHRNB2 P17787 1/20 0.34
CHRNA7 P36544 1/20 0.34
CHRNA4 P43681 1/20 0.34
NPC1 O15118 1/20 0.34
GPR84 Q9NQS5 3/20 0.33
CACNA1G O43497 1/20 0.33
CACNA1B Q00975 1/20 0.33
HTR6 P50406 1/20 0.33
ASH1L Q9NR48 1/20 0.32
MTNR1A P48039 1/20 0.32
MTNR1B P49286 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
SCHEMBL19984035 0.70 HTR2A (0.47) KMT2AMEN1KDM4EALDH1A1SMN1; SMN2
SCHEMBL19983815 0.70 CYP2C9 (0.43) KMT2AMEN1KDM4EALDH1A1SMN1; SMN2
SCHEMBL19983951 0.68 TRPV1 (0.41) KMT2AMEN1KDM4EALDH1A1SMN1; SMN2
SCHEMBL19983959 0.67 KMT2A (0.40) KMT2AMEN1KDM4EALDH1A1SMN1; SMN2
SCHEMBL19983829 0.67 HTR2A (0.44) KDM4EALDH1A1HTR2ACHRNB2CHRNA7
SCHEMBL19984036 0.66 LMNA (0.44) KMT2AMEN1KDM4EALDH1A1SMN1; SMN2
SCHEMBL19984039 0.66 GPR84 (0.50) HTR2AGPR84HTR6
SCHEMBL19983972 0.66 GPR84 (0.40) KMT2AMEN1KDM4EALDH1A1SMN1; SMN2
SCHEMBL19984218 0.66 SLC6A4 (0.39) HTR2ACHRNB2CHRNA7CHRNA4GPR84
SCHEMBL19983976 0.65 GPR84 (0.40) KMT2AMEN1HTR2ACHRNB2CHRNA7

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