SCHEMBL22760109

SCHEMBL22760109

CCOC(=O)c1c(N2CCCCC2)c2cc(F)c(Cl)cc2n1-c1cccc(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.48
LMNA P02545 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPK1 P28482 1/20 0.43
THRB P10828 1/20 0.42
MAPT P10636 3/20 0.42
MAPK8 P45983 1/20 0.40
CASP3 P42574 1/20 0.40
ALDH1A1 P00352 3/20 0.39
GAA P10253 1/20 0.39
ELANE P08246 1/20 0.39
RAB9A P51151 1/20 0.38
HTT P42858 1/20 0.38
TP53 P04637 1/20 0.38
SLC26A6 Q9BXS9 1/20 0.38

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
SCHEMBL22748339 0.94 HPGD (0.42) HPGDLMNAMEN1KMT2AMAPK1
SCHEMBL22760338 0.94 HPGD (0.42) HPGDLMNAMEN1KMT2AMAPK1
SCHEMBL22760214 0.92 MAPT (0.42) HPGDMAPK1THRBMAPTMAPK8
SCHEMBL22760089 0.86 HPGD (0.44) HPGDLMNAMEN1KMT2AMAPK1
SCHEMBL22760057 0.85 SMN1; SMN2 (0.39) HPGDLMNAMEN1KMT2ATHRB
SCHEMBL22748257 0.84 MAPT (0.48) MEN1KMT2ATHRBMAPTMAPK8
SCHEMBL22760215 0.84 HPGD (0.51) HPGDLMNAMEN1KMT2AMAPK1
SCHEMBL22748277 0.84 MEN1 (0.46) LMNAMEN1KMT2AMAPK1THRB
SCHEMBL22760336 0.83 MAPK8 (0.41) LMNAKMT2AMAPTMAPK8ALDH1A1
SCHEMBL22760219 0.82 MAPK8 (0.42) HPGDLMNAMEN1KMT2AMAPK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020244462-A1 INDOLE DERIVATIVES AND PHARMACEUTICAL USE THEREOF 中国药科大学 2020-12-10 WO disclosed
CN-112028815-A Indole derivatives and medical application thereof 中国药科大学 2020-12-04 CN disclosed