SCHEMBL7925825

SCHEMBL7925825

CC1=C([Ti](OC(=O)c2ccc(F)cc2)(OC(=O)c2ccc(F)cc2)OC(=O)c2ccc(F)cc2)C(C)C2=C1CCCC2

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.34
KMT2A Q03164 6/20 0.34
KDM4E B2RXH2 1/20 0.34
CYP1A2 P05177 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 1/20 0.32
MAPT P10636 5/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
CASP3 P42574 2/20 0.32
SENP7 Q9BQF6 2/20 0.32
MAPK1 P28482 2/20 0.32
TRPV1 Q8NER1 1/20 0.32
HTT P42858 1/20 0.32
ATM Q13315 1/20 0.32
SENP8 Q96LD8 1/20 0.31
SENP6 Q9GZR1 1/20 0.31
ADRB2 P07550 1/20 0.31
ADRB1 P08588 1/20 0.31
ADRB3 P13945 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
SCHEMBL7925832 0.88 TSHR (0.34) MEN1KMT2ACYP1A2LMNAGAA
SCHEMBL7927302 0.84 MEN1 (0.35) MEN1KMT2AKDM4ECYP1A2SMN1; SMN2
SCHEMBL7927391 0.81 SMN1; SMN2 (0.38) MEN1KMT2AKDM4ECYP1A2SMN1; SMN2
SCHEMBL7924989 0.78
SCHEMBL7925721 0.74 MEN1 (0.35) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL7931008 0.74 MEN1 (0.38) MEN1KMT2AKDM4ECYP1A2SMN1; SMN2
SCHEMBL7930285 0.74 MEN1 (0.40) MEN1KMT2AKDM4ECYP1A2SMN1; SMN2
SCHEMBL7928326 0.73 KDM4E (0.39) MEN1KMT2AKDM4EMAPTNPC1
SCHEMBL7927380 0.73 MEN1 (0.34) MEN1KMT2AKDM4EALDH1A1
SCHEMBL7928340 0.73 MEN1 (0.34) MEN1KMT2AKDM4EALDH1A1

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