SCHEMBL6823481

SCHEMBL6823481

Cc1ccc2c(c1)c(O)c(C)n2Cc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.63
LMNA P02545 2/20 0.63
ALDH1A1 P00352 3/20 0.54
MEN1 O00255 3/20 0.54
MAPT P10636 3/20 0.52
GAA P10253 2/20 0.52
PKM P14618 2/20 0.52
PLA2G2A P14555 4/20 0.51
KDM4E B2RXH2 1/20 0.50
POLB P06746 1/20 0.49
HPGD P15428 1/20 0.49
TSHR P16473 1/20 0.49
MIF P14174 3/20 0.49
SRC P12931 1/20 0.47
PLA2G1B P04054 1/20 0.47
HTT P42858 1/20 0.47
CYP19A1 P11511 1/20 0.46
CD74 P04233 1/20 0.46
PTGDR2 Q9Y5Y4 1/20 0.46

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
SCHEMBL6821095 0.85 PLA2G2A (0.60) KMT2ALMNAALDH1A1MEN1MAPT
SCHEMBL6821169 0.84 KMT2A (0.52) KMT2ALMNAALDH1A1MEN1MAPT
SCHEMBL679026 0.84 KMT2A (0.64) KMT2ALMNAALDH1A1MEN1MAPT
SCHEMBL6820689 0.83 PLA2G2A (0.68) KMT2ALMNAALDH1A1MEN1MAPT
SCHEMBL6820215 0.81 KMT2A (0.52) KMT2ALMNAALDH1A1MEN1MAPT
SCHEMBL12357944 0.80 CYP19A1 (0.70) KMT2ALMNAALDH1A1MEN1MAPT
SCHEMBL6823808 0.79 MAPT (0.49) KMT2ALMNAMEN1MAPTPKM
SCHEMBL9271117 0.79 KMT2A (0.53) KMT2ALMNAALDH1A1MEN1MAPT
SCHEMBL8358470 0.78 KMT2A (0.72) KMT2ALMNAALDH1A1MEN1MAPT
SCHEMBL6927387 0.78 KMT2A (0.55) KMT2ALMNAALDH1A1MEN1MAPT

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-2004048331-A1 N-ARYLALKYL-3-AMINOALKOXYINDOLES AND THEIR USE AS 5-HT LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2004-06-10 WO disclosed