SCHEMBL26522653

SCHEMBL26522653

CC(=O)N1CC(C(=O)N(C)Cc2ccc(Br)cc2)C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.45
POLB P06746 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
PKM P14618 1/20 0.41
HTT P42858 1/20 0.41
AGTR2 P50052 1/20 0.40
GABRA1 P14867 3/20 0.39
GABRG2 P18507 3/20 0.39
GABRB3 P28472 3/20 0.39
GABRA3 P34903 3/20 0.39
GABRA2 P47869 3/20 0.39
GABRB2 P47870 3/20 0.39
NPC1 O15118 1/20 0.39
HPGD P15428 1/20 0.39
LMNA P02545 1/20 0.39
ALDH1A1 P00352 3/20 0.38
CCR5 P51681 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
PYCR1 P32322 2/20 0.38

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
SCHEMBL26383119 0.86 POLB (0.52) KMT2APOLBSMN1; SMN2PKMHTT
SCHEMBL26522945 0.81 KMT2A (0.50) KMT2APOLBSMN1; SMN2PKMHTT
SCHEMBL26522756 0.80 POLB (0.49) KMT2APOLBSMN1; SMN2PKMHTT
SCHEMBL26522610 0.74 POLB (0.44) KMT2APOLBSMN1; SMN2PKMHTT
SCHEMBL3132202 0.73 ALDH1A1 (0.59) POLBSMN1; SMN2HTTNPC1HPGD
SCHEMBL14590551 0.72 POLB (0.68) KMT2APOLBSMN1; SMN2PKMHTT
SCHEMBL1893045 0.71 PYCR1 (0.52) KMT2ASMN1; SMN2HTTNPC1HPGD
SCHEMBL13838902 0.71 POLB (0.47) KMT2APOLBSMN1; SMN2HPGDALDH1A1
SCHEMBL3132249 0.71 SMN1; SMN2 (0.54) POLBSMN1; SMN2AGTR2NPC1HPGD
SCHEMBL13838906 0.70 POLB (0.46) POLBSMN1; SMN2PKMHTTLMNA

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-2023192506-A1 MALT1 MODULATORS AND USES THEREOF RARIFIED BIOSCIENCES, INC. (US) 2023-10-05 WO disclosed