SCHEMBL7928586

SCHEMBL7928586

O=C(O[Ti]1(OC(=O)c2ccccc2)C2c3ccccc3-c3cccc(c32)CCc2cccc3c2C1c1ccccc1-3)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.39
PARP1 P09874 1/20 0.35
SRD5A1 P18405 1/20 0.35
SRD5A2 P31213 1/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
MTNR1A P48039 1/20 0.34
MTNR1B P49286 1/20 0.34
MAPK14 Q16539 2/20 0.33
LMNA P02545 2/20 0.33
F2 P00734 1/20 0.33
OPRM1 P35372 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
DHODH Q02127 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SLC18A3 Q16572 1/20 0.33
CETP P11597 1/20 0.33
CHRNA7 P36544 1/20 0.33
TP53 P04637 1/20 0.33
TSHR P16473 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
SCHEMBL7924685 0.92 SRD5A2 (0.35) HTTSRD5A2KMT2AMEN1LMNA
SCHEMBL7924959 0.90 MAPT (0.42) HTTKMT2AMEN1MAPK14LMNA
SCHEMBL7925574 0.84 POLB (0.42) KMT2AMEN1TDP1CETP
SCHEMBL7925878 0.82 MEN1 (0.35) KMT2AMEN1LMNATDP1L3MBTL1
SCHEMBL7927183 0.81 DRD1 (0.37) HTTKMT2AMEN1MTNR1AMTNR1B
SCHEMBL7919279 0.81 ALDH1A1 (0.34) HTTKMT2ALMNA
SCHEMBL7930727 0.81 TSHR (0.34) KMT2AMEN1LMNAF2TDP1
SCHEMBL7930914 0.81 ACHE (0.31) HTT
SCHEMBL7925516 0.80 POLB (0.35) HTTKMT2AMEN1TDP1CETP
SCHEMBL7919221 0.79 ALDH1A1 (0.42) HTTMTNR1AMTNR1BLMNASLC18A3

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