SCHEMBL23949935

SCHEMBL23949935

CCCC1Nc2ccc(C(=O)O)cc2C2C=CCC12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 1.00
MEN1 O00255 7/20 1.00
POLB P06746 7/20 1.00
L3MBTL1 Q9Y468 5/20 1.00
MAPT P10636 5/20 1.00
GAA P10253 4/20 1.00
ALDH1A1 P00352 4/20 1.00
NSD2 O96028 2/20 1.00
HPGD P15428 2/20 1.00
APOBEC3A P31941 2/20 0.66
APOBEC3G Q9HC16 2/20 0.66
MASP2 O00187 3/20 0.65
HSPA1A P0DMV8 3/20 0.65
PTPN7 P35236 3/20 0.65
CD44 P16070 1/20 0.65
PTPN1 P18031 1/20 0.65
MSN P26038 1/20 0.65
CDC25B P30305 1/20 0.65
AKT1 P31749 1/20 0.65
EZH2 Q15910 1/20 0.65

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
SCHEMBL23950001 0.80 KMT2A (1.00) KMT2AMEN1POLBL3MBTL1MAPT
SCHEMBL17211738 0.80 HSPA1A (0.81) KMT2AMEN1POLBL3MBTL1MAPT
SCHEMBL2808722 0.79 PTPN7 (1.00) KMT2AMEN1POLBL3MBTL1MAPT
SCHEMBL29415450 0.79 PTPN7 (1.00) KMT2AMEN1POLBL3MBTL1MAPT
SCHEMBL23949487 0.79 KMT2A (1.00) KMT2AMEN1POLBL3MBTL1MAPT
SCHEMBL26458981 0.79 KMT2A (1.00) KMT2AMEN1POLBL3MBTL1MAPT
SCHEMBL23949811 0.76 MAPT (0.81) KMT2AMEN1POLBL3MBTL1MAPT
SCHEMBL681674 0.76 MAPT (0.81) KMT2AMEN1POLBL3MBTL1MAPT
SCHEMBL23949812 0.76 MAPT (0.76) KMT2AMEN1POLBL3MBTL1MAPT
SCHEMBL23950052 0.76 MAPT (0.76) KMT2AMEN1POLBL3MBTL1MAPT

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-2021209689-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING SWEET POTATO AGAINST SWEET POTATO PATHOGENIC VIRUSES HELSINGIN YLIOPISTO (FI) 2021-10-21 WO disclosed