SCHEMBL29244286

SCHEMBL29244286

CC(NC(=O)C(F)(F)F)c1ccc(Cl)cc1Cl

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
LMNA P02545 2/20 0.52
POLB P06746 1/20 0.52
MAPT P10636 1/20 0.52
P2RX7 Q99572 3/20 0.46
CNR1 P21554 1/20 0.45
TP53 P04637 1/20 0.45
HTT P42858 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PDK1 Q15118 1/20 0.43
PDK2 Q15119 1/20 0.43
PDK3 Q15120 1/20 0.43
PDK4 Q16654 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
BDKRB1 P46663 2/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL29150632 0.85 CNR1 (0.43) MEN1KMT2ALMNAPOLBMAPT
SCHEMBL19816585 0.80 MEN1 (0.61) MEN1KMT2ALMNAPOLBMAPT
SCHEMBL30398949 0.80 MEN1 (0.61) MEN1KMT2ALMNAPOLBMAPT
SCHEMBL19816588 0.80 MEN1 (0.61) MEN1KMT2ALMNAPOLBMAPT
SCHEMBL21022756 0.78 MEN1 (0.59) MEN1KMT2ALMNAPOLBMAPT
SCHEMBL4038473 0.77 MEN1 (0.58) MEN1KMT2ALMNAPOLBMAPT
SCHEMBL1685859 0.77 MEN1 (0.54) MEN1KMT2ALMNAPOLBMAPT
SCHEMBL7934857 0.76 MEN1 (0.57) MEN1KMT2ALMNAPOLBMAPT
SCHEMBL5643654 0.75 KMT2A (0.71) MEN1KMT2ALMNAPOLBMAPT
SCHEMBL12480624 0.75 BDKRB1 (0.41) CNR1PDK1PDK2PDK3PDK4

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
CN-118290334-A Preparation method of Lifeiste key intermediate 上海医药工业研究院有限公司 2024-07-05 CN disclosed