SCHEMBL26523045

SCHEMBL26523045

CN(Cc1ccc(Br)cc1)C(=C1CCC1)C1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.40
MEN1 O00255 3/20 0.40
PYCR1 P32322 5/20 0.38
HRH4 Q9H3N8 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
MAOB P27338 1/20 0.38
SIGMAR1 Q99720 1/20 0.36
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPK1 P28482 1/20 0.33

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
SCHEMBL26522945 0.78 KMT2A (0.50) KMT2AMEN1SIGMAR1KDM4EALDH1A1
SCHEMBL26523081 0.78 ALDH1A1 (0.50) PYCR1ALDH1A1
SCHEMBL26522756 0.74 POLB (0.49) KMT2AMEN1PYCR1KDM4EALDH1A1
SCHEMBL1893045 0.65 PYCR1 (0.52) KMT2AMEN1PYCR1MAOBKDM4E
SCHEMBL26522653 0.64 KMT2A (0.45) KMT2AMEN1PYCR1MAOBKDM4E
SCHEMBL1239203 0.63 HRH3 (0.59) PYCR1HRH4HRH3MAOBSIGMAR1
SCHEMBL3132202 0.63 ALDH1A1 (0.59) PYCR1MAOBKDM4EALDH1A1
SCHEMBL26522610 0.63 POLB (0.44) KMT2APYCR1MAOBKDM4EALDH1A1
SCHEMBL19750331 0.63 MEN1 (0.64) KMT2AMEN1KDM4EALDH1A1MAPK1
SCHEMBL26383119 0.62 POLB (0.52) KMT2AMEN1MAOBKDM4EALDH1A1

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