SCHEMBL8312798

SCHEMBL8312798

CC1CC(=O)N(c2cccc(C(=O)NCc3ccc(F)cc3)c2)C1=O

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
POLB P06746 2/20 0.52
ALDH1A1 P00352 3/20 0.49
LMNA P02545 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
GAA P10253 1/20 0.46
TSHR P16473 1/20 0.45
TP53 P04637 1/20 0.44

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
SCHEMBL12964166 0.76 LMNA (0.55) MEN1KMT2APOLBALDH1A1LMNA
SCHEMBL185381 0.76 L3MBTL1 (0.64) MEN1KMT2AALDH1A1LMNATSHR
SCHEMBL822035 0.73 ALDH1A1 (0.49) MEN1KMT2AALDH1A1SMN1; SMN2GAA
SCHEMBL8312797 0.72 ALDH1A1 (0.56) MEN1KMT2APOLBALDH1A1SMN1; SMN2
SCHEMBL7175171 0.71 CFD (0.62) MEN1KMT2AALDH1A1LMNATSHR
SCHEMBL15165753 0.71 PPARG (0.64) MEN1KMT2AALDH1A1LMNATSHR
SCHEMBL31324991 0.70 LMNA (0.60) MEN1KMT2AALDH1A1LMNASMN1; SMN2
SCHEMBL1155517 0.69 ALDH1A1 (0.72) MEN1KMT2APOLBALDH1A1LMNA
SCHEMBL20804634 0.69 L3MBTL1 (0.70) MEN1KMT2AALDH1A1LMNASMN1; SMN2
SCHEMBL10294658 0.69 MEN1 (0.54) MEN1KMT2AALDH1A1LMNASMN1; SMN2

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-2004063213-A2 PEPTIDES WHICH TARGET TUMOR AND ENDOTHELIAL CELLS, COMPOSITIONS AND USES THEREOF ATTENUON, LLC (US) 2004-07-29 WO disclosed