SCHEMBL7924742

SCHEMBL7924742

C[O-].C[O-].O=C(O[Ti+2]C1CCCC2=C1CC1=C2CCCC1)c1ccc(F)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
MAPT P10636 6/20 0.34
CASP3 P42574 2/20 0.34
SENP7 Q9BQF6 2/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
KDM4E B2RXH2 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
CYP1A2 P05177 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
EPHX2 P34913 1/20 0.31
ALDH1A1 P00352 1/20 0.31
NPSR1 Q6W5P4 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
Hydrochloric Acid SCHEMBL7927362 0.95 MEN1 (0.36) MEN1KMT2AMAPTCASP3SENP7
SCHEMBL7927639 0.88 LMNA (0.34) MEN1KMT2AMAPTHTTKDM4E
Hydrochloric Acid SCHEMBL7919305 0.83 LMNA (0.36) MEN1KMT2AMAPTHTTKDM4E
SCHEMBL7919189 0.82
SCHEMBL7928302 0.81 MEN1 (0.35) MEN1KMT2AMAPTCASP3SENP7
SCHEMBL7924740 0.81 KDM4E (0.37) MEN1KMT2AMAPTCASP3SENP7
SCHEMBL7931154 0.80 MEN1 (0.34) MEN1KMT2AMAPTCASP3SENP7
SCHEMBL7930769 0.79
Hydrochloric Acid SCHEMBL7930886 0.78
SCHEMBL7927603 0.78

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