SCHEMBL24676677

SCHEMBL24676677

CCOC(=O)Cc1nc(C(F)(F)F)cs1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
SDHB P21912 1/20 0.42
MAPT P10636 3/20 0.41
PKM P14618 1/20 0.41
HTT P42858 1/20 0.41
GAA P10253 1/20 0.41
ALDH1A1 P00352 3/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
LMNA P02545 2/20 0.40
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KCNH2 Q12809 1/20 0.39

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
SCHEMBL696137 0.80 MEN1 (0.51) MEN1KMT2ASMN1; SMN2MAPTPKM
SCHEMBL2844080 0.78 MEN1 (0.50) MEN1KMT2ASMN1; SMN2MAPTPKM
SCHEMBL11905059 0.78 POLB (0.43) POLBMEN1KMT2ASMN1; SMN2SDHB
SCHEMBL2852600 0.78 L3MBTL1 (0.64) POLBMEN1KMT2AMAPTGAA
SCHEMBL2657920 0.78 MEN1 (0.54) POLBMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL18722146 0.77 MEN1 (0.56) POLBMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL11199790 0.77 MEN1 (0.49) POLBMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL25309164 0.77 MEN1 (0.49) MEN1KMT2ASMN1; SMN2MAPTPKM
SCHEMBL2654211 0.77 KMT2A (0.49) MEN1KMT2ASMN1; SMN2MAPTPKM
SCHEMBL2846375 0.76 POLB (0.42) POLBMEN1KMT2ASMN1; SMN2MAPT

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-2022155941-A1 CDK2 INHIBITORS QILU REGOR THERAPEUTICS INC. (CN) 2022-07-28 WO disclosed