SCHEMBL7925446

SCHEMBL7925446

C[Ti](C)(=[SiH2])(OC(=O)c1cccc2ccccc12)(OC(=O)c1cccc2ccccc12)(C1C=Cc2ccccc21)C1C=Cc2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
MEN1 O00255 3/20 0.37
RCE1 Q9Y256 1/20 0.37
ADRB2 P07550 2/20 0.37
ADRB1 P08588 2/20 0.37
ADRB3 P13945 2/20 0.37
CDC25B P30305 1/20 0.36
KDM4E B2RXH2 3/20 0.36
HPGD P15428 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NR4A1 P22736 1/20 0.36
NR4A2 P43354 1/20 0.36
NR4A3 Q92570 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
PLK1 P53350 1/20 0.36
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
ALDH1A1 P00352 3/20 0.35

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
SCHEMBL7925657 0.82 HRH3 (0.33) KMT2APOLBGAAMEN1ADRB2
SCHEMBL7925643 0.80 MEN1 (0.38) KMT2AGAAMEN1NPC1RAB9A
SCHEMBL7930986 0.79 POLB (0.35) KMT2APOLBMEN1
SCHEMBL28872350 0.76 KMT2A (0.43) KMT2APOLBGAAMEN1RCE1
SCHEMBL7925897 0.76 RAB9A (0.34) KMT2APOLBGAAMEN1ADRB2
SCHEMBL7928246 0.76 RET (0.34) ALDH1A1LMNASMN1; SMN2
SCHEMBL7925603 0.75 RET (0.35) KMT2AMEN1LMNASMN1; SMN2
SCHEMBL7928114 0.75 MEN1 (0.30) KMT2AMEN1
SCHEMBL7930322 0.75 ELANE (0.31) KMT2AMEN1MAPTLMNA
SCHEMBL7925125 0.74 ATM (0.31)

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