SCHEMBL7928732

SCHEMBL7928732

C=CC(=O)O[Ti](OC(=O)C=C)(c1cccc2c1Cc1ccccc1-2)(c1cccc2c1Cc1ccccc1-2)=[Si](C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
HTR2B P41595 2/20 0.36
HTR7 P34969 1/20 0.36
PNMT P11086 1/20 0.33
GABRP O00591 1/20 0.31
GABRD O14764 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB1 P18505 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31
GABRB2 P47870 1/20 0.31
GABRA4 P48169 1/20 0.31
GABRE P78334 1/20 0.31
GABRA6 Q16445 1/20 0.31
GABRG1 Q8N1C3 1/20 0.31
GABRG3 Q99928 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
SCHEMBL7927601 0.85 RAB9A (0.47) RAB9ANPC1HTR2BHTR7PNMT
SCHEMBL7919142 0.83 RAB9A (0.44) RAB9ANPC1HTR2BHTR7PNMT
SCHEMBL7924642 0.82 RAB9A (0.41) RAB9ANPC1HTR2BHTR7PNMT
SCHEMBL7930731 0.82 NPC1 (0.41) RAB9ANPC1HTR2BHTR7PNMT
SCHEMBL7919283 0.82 RAB9A (0.41) RAB9ANPC1HTR2BHTR7PNMT
SCHEMBL7925414 0.81 NPC1 (0.40) RAB9ANPC1HTR2BHTR7PNMT
SCHEMBL7927570 0.80 NPC1 (0.40) RAB9ANPC1HTR2BHTR7PNMT
SCHEMBL7919492 0.80 NPC1 (0.40) RAB9ANPC1HTR2BHTR7PNMT
SCHEMBL7919528 0.78 HTR7 (0.39) RAB9ANPC1HTR2BHTR7MAPT
SCHEMBL7919527 0.78 MAPT (0.38) RAB9ANPC1HTR2BHTR7PNMT

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