SCHEMBL22735631

SCHEMBL22735631

CN(CCOCCNC(=O)OC(C)(C)C)CCOCCNc1ccnc2cc(Cl)ccc12

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FERMT2 Q96AC1 4/20 0.52
▸ KDM4E B2RXH2 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ NR4A2 P43354 2/20 0.48
▸ CCR1 P32246 1/20 0.47
▸ CDK1 P06493 1/20 0.47
▸ BACE1 P56817 1/20 0.46
▸ KMT2A Q03164 1/20 0.45

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
SCHEMBL23340186 0.90 FERMT2 (0.56) FERMT2KDM4ELMNAHTTHSD17B10
SCHEMBL22734279 0.87 FERMT2 (0.67) FERMT2KDM4ELMNAHTTHSD17B10
SCHEMBL23904665 0.84 CCR1 (0.66) FERMT2KDM4ELMNAHTTHSD17B10
SCHEMBL22735859 0.84 FERMT2 (0.63) FERMT2KDM4ELMNAHTTHSD17B10
SCHEMBL17527085 0.83 CDK1 (0.62) FERMT2KDM4ELMNAHTTHSD17B10
SCHEMBL22735553 0.82 FERMT2 (0.67) FERMT2KDM4ELMNAHTTHSD17B10
SCHEMBL17527064 0.82 CDK1 (0.61) FERMT2KDM4ELMNAHTTHSD17B10
SCHEMBL19399297 0.80 CDK1 (0.60) FERMT2KDM4ELMNAHTTHSD17B10
SCHEMBL22734289 0.79 CYP1A2 (0.57) FERMT2KDM4ELMNAHTTHSD17B10
SCHEMBL22735629 0.79 FERMT2 (0.56) FERMT2KDM4ELMNAHTTHSD17B10

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
WO-2020243037-A1 BISAMINOQUINOLINES AND BISAMINOACRIDINES COMPOUNDS AND METHODS OF THEIR USE THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2020-12-03 — — WO disclosed
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