SCHEMBL31171963

SCHEMBL31171963

CC1(C)c2cc(Br)ccc2N(CCCBr)c2ccc(Br)cc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.43
MEN1 O00255 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
PRMT1 Q99873 2/20 0.39
PKM P14618 2/20 0.38
TP53 P04637 4/20 0.38
MAPT P10636 4/20 0.38
PRMT5 O14744 1/20 0.38
CARM1 Q86X55 1/20 0.38
PRMT8 Q9NR22 1/20 0.38
KCNK2 O95069 3/20 0.38
THRB P10828 1/20 0.37
ALDH1A1 P00352 3/20 0.37
LMNA P02545 2/20 0.37
KCNK10 P57789 1/20 0.36
KCNK4 Q9NYG8 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HTT P42858 1/20 0.34
ANPEP P15144 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
SCHEMBL31171874 0.95 KMT2A (0.42) KMT2AMEN1CYP1A2CYP2D6PRMT1
SCHEMBL31171935 0.90 PKM (0.40) KMT2AMEN1CYP1A2CYP2D6PRMT1
SCHEMBL29185411 0.80 ALDH1A1 (0.48) KMT2AMEN1PRMT1PKMTP53
SCHEMBL29025689 0.79 KMT2A (0.44) KMT2AMEN1CYP1A2CYP2D6PKM
SCHEMBL29274061 0.79 KMT2A (0.43) KMT2AMEN1CYP1A2CYP2D6PRMT1
SCHEMBL30918129 0.79 KMT2A (0.43) KMT2AMEN1CYP1A2CYP2D6PRMT1
SCHEMBL30918128 0.79 KMT2A (0.43) KMT2AMEN1CYP1A2CYP2D6PRMT1
SCHEMBL29025580 0.78 KCNK2 (0.52) KMT2AMEN1CYP1A2CYP2D6PRMT1
SCHEMBL16148951 0.78 PKM (0.36) KMT2AMEN1CYP1A2CYP2D6PRMT1
SCHEMBL31711749 0.77 PGR (0.41) KMT2AMEN1PKMTP53MAPT

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-118755057-A Hole-transporting polymer material, preparation method and application 昆山协鑫光电材料有限公司 2024-10-11 CN disclosed