SCHEMBL30758595

SCHEMBL30758595

Cc1cccc(NC(=O)c2ccccc2Br)c1

nearest known ligand 0.73

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.73
ALDH1A1 P00352 2/20 0.73
SMN1; SMN2 Q16637 1/20 0.73
KMT2A Q03164 3/20 0.70
MEN1 O00255 2/20 0.70
F2R P25116 9/20 0.68
NPC1 O15118 2/20 0.68
L3MBTL1 Q9Y468 1/20 0.65
SORT1 Q99523 1/20 0.62
KCNK3 O14649 1/20 0.59
KCNK9 Q9NPC2 1/20 0.59
RXFP1 Q9HBX9 1/20 0.59

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
SCHEMBL29168826 1.00 RAB9A (0.73) RAB9AALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL28669917 0.85 ALDH1A1 (0.70) RAB9AALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL10069454 0.84 F2R (0.72) RAB9AALDH1A1SMN1; SMN2KMT2AF2R
SCHEMBL533767 0.84 KCNK3 (0.81) RAB9AALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL16941525 0.83 MEN1 (0.72) RAB9AALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL259352 0.83 MEN1 (0.72) RAB9AALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL3356211 0.83 MEN1 (1.00) ALDH1A1KMT2AMEN1L3MBTL1SORT1
SCHEMBL31424193 0.83 MEN1 (0.72) RAB9AALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL7181742 0.82 MEN1 (0.71) RAB9AALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL8060238 0.82 NPC1 (0.75) RAB9AALDH1A1SMN1; SMN2KMT2AMEN1

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
CN-117466799-B N-substituted phthalic acid diamide preparation method of imine compound 西北师范大学 2024-12-24 CN claimed
CN-117466799-B N-substituted phthalic acid diamide preparation method of imine compound 西北师范大学 2024-12-24 CN disclosed
CN-117466799-A Preparation method of N-substituted phthalimide compound 西北师范大学 2024-01-30 CN disclosed