SCHEMBL7130441

SCHEMBL7130441

Cc1ccc(C=C2C(=O)Nc3c(Br)cc(Br)c(C)c32)o1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 14/20 0.49
MEN1 O00255 13/20 0.49
POLB P06746 11/20 0.49
ALDH1A1 P00352 9/20 0.49
LMNA P02545 4/20 0.49
THRB P10828 2/20 0.49
ALOX12 P18054 2/20 0.49
DYRK1A Q13627 1/20 0.49
MAPT P10636 9/20 0.43
L3MBTL1 Q9Y468 6/20 0.43
PKM P14618 4/20 0.43
MAPK1 P28482 1/20 0.43
CTDSP1 Q9GZU7 1/20 0.43
GAA P10253 5/20 0.41
HPGD P15428 3/20 0.40
RECQL P46063 3/20 0.40
GPR55 Q9Y2T6 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
GFER P55789 1/20 0.40
TDP1 Q9NUW8 3/20 0.39

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
SCHEMBL7138379 0.90 RET (0.48) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL7135682 0.85 PTPN1 (0.38) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL7136583 0.84 ALDH1A1 (0.38) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL7138197 0.83 KMT2A (0.54) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL7131028 0.82 ALDH1A1 (0.33) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL7134033 0.81 MAPT (0.51) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL5364403 0.81 KMT2A (0.56) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL7131043 0.80 PIM1 (0.45) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL7138862 0.77 MAPT (0.47) KMT2AMEN1POLBALDH1A1MAPT
SCHEMBL7138182 0.77 KMT2A (0.42) KMT2AMEN1ALDH1A1MAPTRET

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-6506763-B2 Useful in prevention and treatment of protein kinase related disorders such as cancer SUGEN, INC. 2003-01-14 US disclosed