SCHEMBL7927281

SCHEMBL7927281

O=C(O[Ti](OC(=O)C(c1ccccc1)(c1ccccc1)c1ccccc1)(C1c2ccccc2-c2ccccc21)C1c2ccccc2-c2ccccc21)C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 5/20 0.46
POLB P06746 1/20 0.37
NPSR1 Q6W5P4 2/20 0.36
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
HDAC5 Q9UQL6 1/20 0.34
NCOR2 Q9Y618 1/20 0.34
KMT2A Q03164 2/20 0.33
CYP1A2 P05177 1/20 0.33
TSHR P16473 1/20 0.33
MEN1 O00255 1/20 0.33
ATM Q13315 1/20 0.33
MAPT P10636 1/20 0.33
EDNRB P24530 1/20 0.33
EDNRA P25101 1/20 0.33

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
SCHEMBL7919309 0.88 KCNN4 (0.46) KCNN4POLBNPSR1HDAC3HDAC4
SCHEMBL7930622 0.81 POLB (0.42) POLBNPSR1HDAC3HDAC4HDAC7
SCHEMBL7930323 0.76 POLB (0.56) POLBHDAC3HDAC4HDAC7HDAC8
SCHEMBL7924480 0.76 F2 (0.44) POLBHDAC3HDAC4HDAC7HDAC8
SCHEMBL7928576 0.74 KCNN4 (0.61) KCNN4NPSR1HDAC3HDAC4HDAC7
SCHEMBL7931012 0.74 KCNN4 (0.41) KCNN4ATM
SCHEMBL29398623 0.72 FABP5 (0.51) KCNN4KMT2A
SCHEMBL7930336 0.71 POLB (0.39) POLBHDAC3HDAC4HDAC7HDAC8
SCHEMBL7925873 0.71 POLB (0.39) POLBHDAC3HDAC4HDAC7HDAC8
SCHEMBL7919158 0.71 POLB (0.42) 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