SCHEMBL7931022

SCHEMBL7931022

O=C(O[Ti]1(OC(=O)c2cccc3ccccc23)C2C(=Cc3ccccc32)CCC2=Cc3ccccc3C21)c1cccc2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
NR4A1 P22736 1/20 0.37
NR4A2 P43354 1/20 0.37
NR4A3 Q92570 1/20 0.37
HPGD P15428 3/20 0.37
KDM4E B2RXH2 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
BCHE P06276 1/20 0.35
MMP3 P08254 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
CDC25B P30305 2/20 0.34
ALDH1A1 P00352 3/20 0.34
MEN1 O00255 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HRH3 Q9Y5N1 1/20 0.34
HSP90AA1 P07900 1/20 0.34
MAPT P10636 1/20 0.34
PTPN1 P18031 1/20 0.34

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
SCHEMBL7927283 0.93 KMT2A (0.39) KMT2APOLBGAANR4A1NR4A2
SCHEMBL7925437 0.82 KMT2A (0.38) KMT2APOLBGAANR4A1NR4A2
SCHEMBL7924741 0.80 LMNA (0.36) KMT2APOLBGAAALDH1A1MEN1
SCHEMBL7927787 0.77 POLB (0.35) POLBALDH1A1SMN1; SMN2
SCHEMBL7919202 0.76 NPC1 (0.35) KMT2APOLBGAAL3MBTL1MEN1
SCHEMBL7927339 0.74 KMT2A (0.37) KMT2APOLBGAANR4A1NR4A2
SCHEMBL7924666 0.74 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2
SCHEMBL7931007 0.74 LMNA (0.33) KMT2AMEN1MAPT
SCHEMBL7925758 0.74 THRB (0.33)
SCHEMBL7919208 0.74 ALDH1A1 (0.32) BCHEALDH1A1SMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0867454-B1 POLYMERIZATION CATALYST AND PROCESS FOR PRODUCING POLYMERS IDEMITSU KOSAN CO (JP) 2001-03-21 EP disclosed
US-6075102-A Polymerization catalyst and process for producing polymers IDEMITSU KOSAN CO., LTD. (JP) 2000-06-13 US disclosed
EP-0867454-A1 POLYMERIZATION CATALYST AND PROCESS FOR PRODUCING POLYMERS IDEMITSU KOSAN COMPANY LIMITED (JP) 1998-09-30 EP disclosed