SCHEMBL7927434

SCHEMBL7927434

C=C(C)C(=O)O[Ti](OC(=O)C(=C)C)(OC(=O)C(=C)C)C1c2ccccc2-c2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.45
ELANE P08246 1/20 0.36
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HDAC9 Q9UKV0 1/20 0.35
HDAC5 Q9UQL6 1/20 0.35
NCOR2 Q9Y618 1/20 0.35
KMT2A Q03164 2/20 0.35
GAA P10253 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
GPR3 P46089 1/20 0.32
ALDH1A1 P00352 2/20 0.31
NOTUM Q6P988 1/20 0.31
CYP1A2 P05177 1/20 0.31
TSHR P16473 1/20 0.31
MAPT P10636 2/20 0.30

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
SCHEMBL7927580 0.87 POLB (0.45) POLBELANEHDAC3HDAC4HDAC7
SCHEMBL7927405 0.83 POLB (0.55) POLBHDAC3HDAC4HDAC7HDAC8
SCHEMBL2775729 0.76 POLB (0.55) POLBELANEHDAC3HDAC4HDAC7
SCHEMBL31567542 0.76 POLB (0.55) POLBELANEHDAC3HDAC4HDAC7
SCHEMBL7927360 0.75 POLB (0.42) POLBELANEHDAC3HDAC4HDAC7
SCHEMBL7928102 0.75 POLB (0.42) POLBELANEHDAC3HDAC4HDAC7
SCHEMBL7924577 0.75 POLB (0.39) POLBHDAC3HDAC4HDAC7HDAC8
SCHEMBL7930323 0.74 POLB (0.56) POLBHDAC3HDAC4HDAC7HDAC8
SCHEMBL7924996 0.73 F2 (0.44) POLBELANEHDAC3HDAC4HDAC7
SCHEMBL7919138 0.73 POLB (0.40) POLBHDAC3HDAC4HDAC7HDAC8

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