SCHEMBL31028403

SCHEMBL31028403

O=C(CF)Nc1ccccc1Oc1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 1/20 0.72
L3MBTL1 Q9Y468 7/20 0.70
GAA P10253 4/20 0.70
POLB P06746 2/20 0.67
ATM Q13315 1/20 0.65
ALDH1A1 P00352 4/20 0.60
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
TDP1 Q9NUW8 3/20 0.58
LMNA P02545 3/20 0.58
RECQL P46063 1/20 0.58
PKM P14618 1/20 0.57
KDM4E B2RXH2 4/20 0.55
NPSR1 Q6W5P4 2/20 0.54
MAPT P10636 2/20 0.54

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
SCHEMBL10027978 0.88 ADRA2C (0.79) ADRA2CL3MBTL1GAAPOLBATM
SCHEMBL18666145 0.84 ADRA2C (1.00) ADRA2CL3MBTL1GAAPOLBATM
SCHEMBL11728156 0.84 ADRA2C (0.72) ADRA2CL3MBTL1GAAPOLBATM
SCHEMBL7930541 0.84 ADRA2C (0.72) ADRA2CL3MBTL1GAAPOLBATM
SCHEMBL7720888 0.84 L3MBTL1 (0.74) ADRA2CL3MBTL1GAAPOLBATM
SCHEMBL8150888 0.84 ADRA2C (0.72) ADRA2CL3MBTL1GAAPOLBATM
SCHEMBL10027953 0.83 L3MBTL1 (0.81) ADRA2CL3MBTL1GAAPOLBATM
SCHEMBL18415528 0.81 ADRA2C (0.68) ADRA2CL3MBTL1GAAPOLBATM
SCHEMBL10784048 0.81 ADRA2C (0.68) ADRA2CL3MBTL1GAAPOLBATM
SCHEMBL11372428 0.80 ALDH1A1 (0.65) L3MBTL1POLBALDH1A1MEN1KMT2A

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-118414355-A Methods of inhibiting microglial activation 迪赞纳生命科学公开有限公司 2024-07-30 CN disclosed