SCHEMBL9679386

SCHEMBL9679386

CC(C)c1cccc(C(C)C)c1NC(=O)C(NC(=O)O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.55
LMNA P02545 1/20 0.55
TP53 P04637 1/20 0.48
MEN1 O00255 2/20 0.48
THRB P10828 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL9679376 1.00 KMT2A (0.55) KMT2ALMNATP53MEN1THRB
SCHEMBL6719402 0.93 TP53 (0.56) KMT2ALMNATP53MEN1THRB
SCHEMBL6722718 0.83 MEN1 (0.64) KMT2ALMNATP53MEN1THRB
SCHEMBL9678908 0.81 KMT2A (0.51) KMT2ALMNAMEN1
SCHEMBL8337684 0.79 CTSS (0.54) KMT2ATP53MEN1THRB
SCHEMBL5799250 0.79 KMT2A (0.58) KMT2ALMNAMEN1
SCHEMBL9679740 0.79 KMT2A (0.58) KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL6716780 0.78 CRHBP (0.61) KMT2ALMNATP53MEN1SMN1; SMN2
SCHEMBL6715723 0.77 MEN1 (0.55) KMT2AMEN1THRB
SCHEMBL8845511 0.77 KMT2A (0.68) KMT2ALMNAMEN1SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0415413-A1 Acat inhibitors WARNER-LAMBERT COMPANY (US) 1991-03-06 EP claimed
US-5153226-A Administering as anticholesterol agents, for atherosclerosis WARNER-LAMBERT COMPANY (US) 1992-10-06 US disclosed
EP-0415413-A1 Acat inhibitors WARNER-LAMBERT COMPANY (US) 1991-03-06 EP disclosed