SCHEMBL7925878

SCHEMBL7925878

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

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 3/20 0.34
POLB P06746 2/20 0.34
LMNA P02545 2/20 0.34
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HTR1A P08908 2/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CETP P11597 1/20 0.33
DRD2 P14416 1/20 0.33
PIN1 Q13526 1/20 0.32
RIPK1 Q13546 1/20 0.32
TAS1R3 Q7RTX0 2/20 0.32
TAS1R1 Q7RTX1 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
HTR2A P28223 1/20 0.32
HBB P68871 1/20 0.31

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
SCHEMBL7924812 0.92 HTR2A (0.35) MEN1KMT2AALDH1A1POLBLMNA
SCHEMBL7925574 0.87 POLB (0.42) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL7925573 0.86 KCNN4 (0.36) MEN1KMT2A
SCHEMBL7927183 0.84 DRD1 (0.37) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL7927227 0.84 POLB (0.33) ALDH1A1POLBHBBHSD17B10
SCHEMBL7925516 0.82 POLB (0.35) MEN1KMT2AALDH1A1POLBHTR1A
SCHEMBL7928586 0.82 HTT (0.39) MEN1KMT2ALMNAL3MBTL1CETP
SCHEMBL7919221 0.81 ALDH1A1 (0.42) ALDH1A1LMNAHTR1ADRD2HTR2A
SCHEMBL7919279 0.81 ALDH1A1 (0.34) KMT2AALDH1A1POLBLMNAHTR1A
SCHEMBL7930914 0.81 ACHE (0.31) POLBMAPTTAS1R3TAS1R1

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