SCHEMBL26845482

SCHEMBL26845482

CCN1C=C/C(=C\C=C\c2sc3ccccc3[n+]2CC[O-])c2ccc(Cl)cc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.41
MEN1 O00255 4/20 0.41
HTT P42858 4/20 0.41
BLM P54132 3/20 0.41
NPC1 O15118 5/20 0.40
RAB9A P51151 5/20 0.40
APP P05067 4/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
APAF1 O14727 1/20 0.40
ITGB2 P05107 1/20 0.40
ALPL P05186 1/20 0.40
ITGAM P11215 1/20 0.40
GFER P55789 1/20 0.40
USP2 O75604 2/20 0.38
MTOR P42345 1/20 0.38
MAPT P10636 2/20 0.37
THRB P10828 2/20 0.37
PKM P14618 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL26845477 0.97 KMT2A (0.42) KMT2AMEN1HTTBLMNPC1
SCHEMBL13359367 0.92 KMT2A (0.41) KMT2AMEN1HTTBLMNPC1
SCHEMBL26845399 0.90 KMT2A (0.37) KMT2AMEN1HTTBLMNPC1
SCHEMBL26845387 0.89 PRMT1 (0.42) KMT2AMEN1HTTBLMNPC1
SCHEMBL13124538 0.86 MEN1 (0.37) KMT2AMEN1HTTBLMNPC1
SCHEMBL26845313 0.84 PRMT1 (0.47) KMT2AMEN1HTTBLMNPC1
SCHEMBL26845402 0.83 PRMT5 (0.34) PRMT1PRMT5CARM1
SCHEMBL26845299 0.82 PRMT1 (0.46) KMT2AMEN1HTTBLMNPC1
SCHEMBL13107781 0.81 NPC1 (0.49) KMT2AMEN1HTTBLMNPC1
SCHEMBL26845376 0.81 PRMT1 (0.45) KMT2AMEN1HTTBLMNPC1

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
US-11835457-B2 Fluorescent composition for detecting biological material BIOACTS CORPORATION (KR) 2023-12-05 US disclosed