SCHEMBL24878628

SCHEMBL24878628

CC(=O)Nc1ccc(-c2ccc(F)cc2)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.79
HTT P42858 1/20 0.79
L3MBTL1 Q9Y468 1/20 0.79
KMT2A Q03164 8/20 0.72
MEN1 O00255 6/20 0.72
POLB P06746 2/20 0.72
PTPN1 P18031 1/20 0.63
LMNA P02545 1/20 0.60
GAA P10253 1/20 0.60
IDO1 P14902 1/20 0.58
ALDH1A1 P00352 4/20 0.57
MAPT P10636 3/20 0.57
TDP1 Q9NUW8 1/20 0.57
CA12 O43570 1/20 0.57
BRD4 O60885 1/20 0.57
NR1I2 O75469 1/20 0.57
CA1 P00915 1/20 0.57
CA2 P00918 1/20 0.57
MB P02144 1/20 0.57
CYP1A1 P04798 1/20 0.57

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
SCHEMBL2615418 0.94 KMT2A (0.81) SMN1; SMN2HTTL3MBTL1KMT2AMEN1
SCHEMBL1753885 0.94 KMT2A (0.81) SMN1; SMN2HTTL3MBTL1KMT2AMEN1
Hydrochloric Acid SCHEMBL30443411 0.91 KMT2A (0.78) SMN1; SMN2HTTL3MBTL1KMT2AMEN1
SCHEMBL3818831 0.89 SMN1; SMN2 (1.00) SMN1; SMN2HTTL3MBTL1KMT2AMEN1
SCHEMBL31500695 0.88 KMT2A (0.66) SMN1; SMN2HTTL3MBTL1KMT2AMEN1
SCHEMBL4455279 0.88 KMT2A (0.72) SMN1; SMN2HTTL3MBTL1KMT2AMEN1
SCHEMBL9762638 0.83 SMN1; SMN2 (0.86) SMN1; SMN2HTTL3MBTL1KMT2AMEN1
SCHEMBL10924278 0.82 KMT2A (0.68) SMN1; SMN2HTTL3MBTL1KMT2AMEN1
SCHEMBL14384682 0.82 KMT2A (0.66) SMN1; SMN2HTTL3MBTL1KMT2AMEN1
SCHEMBL17316953 0.82 HTT (0.63) SMN1; SMN2HTTL3MBTL1KMT2AMEN1

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-2023280294-A1 TARGET AND SMALL MOLECULE COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES OR CENTRAL NERVOUS SYSTEM INJURY 北京干细胞与再生医学研究院 2023-01-12 WO disclosed