SCHEMBL14619952

SCHEMBL14619952

CC(=O)C(O)C(NC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.63
HPGD P15428 1/20 0.63
HDAC1 Q13547 1/20 0.56
ALDH1A1 P00352 6/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
TP53 P04637 1/20 0.55
CTRB1 P17538 1/20 0.49
NPC1 O15118 2/20 0.46
RAB9A P51151 1/20 0.46
HPGDS O60760 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
GPR139 Q6DWJ6 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
SCHEMBL14009879 1.00 LMNA (0.63) LMNAHPGDHDAC1ALDH1A1SMN1; SMN2
SCHEMBL1271236 0.86 LMNA (0.67) LMNAHPGDHDAC1ALDH1A1SMN1; SMN2
SCHEMBL6277 0.86 LMNA (0.67) LMNAHPGDHDAC1ALDH1A1SMN1; SMN2
SCHEMBL4164616 0.86 LMNA (0.67) LMNAHPGDHDAC1ALDH1A1SMN1; SMN2
SCHEMBL8108955 0.86 LMNA (0.67) LMNAHPGDHDAC1ALDH1A1SMN1; SMN2
SCHEMBL27882748 0.86 LMNA (0.67) LMNAHPGDHDAC1ALDH1A1SMN1; SMN2
SCHEMBL530337 0.86 LMNA (0.67) LMNAHPGDHDAC1ALDH1A1SMN1; SMN2
Water SCHEMBL8429009 0.85 LMNA (0.65) LMNAHPGDHDAC1ALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL28442347 0.85 LMNA (0.65) LMNAHPGDHDAC1ALDH1A1SMN1; SMN2
SCHEMBL887421 0.85 LMNA (0.65) LMNAHPGDHDAC1ALDH1A1SMN1; 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
US-7173137-B2 Epothilone analogs THE SCRIPPS RESEARCH INSTITUTE (US) 2007-02-06 US disclosed