SCHEMBL6426720

SCHEMBL6426720

NC(=O)OCCC(=O)Nc1cnn(CCF)c1NC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
MAPT P10636 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL5498693 0.83 MAPT (0.33) LMNAMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL6066242 0.80 SLC6A1 (0.32) LMNA
SCHEMBL6386231 0.80 CYP3A4 (0.36) LMNAMEN1KMT2A
SCHEMBL6426899 0.78 MEN1 (0.31) MEN1KMT2A
SCHEMBL6065063 0.77 MEN1 (0.30) MEN1KMT2A
SCHEMBL28760707 0.76 MEN1 (0.35) LMNAMEN1KMT2AMAPT
SCHEMBL28755600 0.73 NTRK1 (0.39) LMNAMEN1KMT2AMAPT
SCHEMBL5500962 0.72 ADRA2C (0.39)
SCHEMBL3116816 0.72 GAA (0.35) LMNAMEN1KMT2A
SCHEMBL6065815 0.71 LPAR1 (0.33) LMNA

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
EP-1556389-A1 CEPHEM COMPOUNDS Astellas Pharma Inc. (JP) 2005-07-27 EP disclosed
WO-2004039814-A1 CEPHEM COMPOUNDS ASTELLAS PHARMA INC. (JP) 2004-05-13 WO disclosed