SCHEMBL6707325

SCHEMBL6707325

COC(=O)c1ccc(-c2ccc(C=Cc3ccc(-c4nc5cc(C)ccc5o4)cc3)cc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 10/20 0.69
RAB9A P51151 8/20 0.69
KDM4E B2RXH2 8/20 0.69
MAPT P10636 7/20 0.69
HPGD P15428 7/20 0.69
NPC1 O15118 7/20 0.69
ALDH1A1 P00352 7/20 0.69
HSD17B10 Q99714 7/20 0.69
NFKB1 P19838 1/20 0.69
NFKB2 Q00653 1/20 0.69
RELA Q04206 1/20 0.69
ATM Q13315 1/20 0.69
TP53 P04637 5/20 0.65
HSPD1 P10809 1/20 0.56
PTPN2 P17706 1/20 0.56
PTPN1 P18031 1/20 0.56
PTPN5 P54829 1/20 0.56
HSPE1 P61604 1/20 0.56
HDAC6 Q9UBN7 2/20 0.54
THRB P10828 1/20 0.53

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
SCHEMBL1258969 0.99 SMN1; SMN2 (0.71) SMN1; SMN2RAB9AKDM4EMAPTHPGD
SCHEMBL9767559 0.99 SMN1; SMN2 (0.71) SMN1; SMN2RAB9AKDM4EMAPTHPGD
SCHEMBL7602089 0.92 SMN1; SMN2 (0.81) SMN1; SMN2RAB9AKDM4EMAPTHPGD
SCHEMBL6705598 0.86 MAPT (0.58) SMN1; SMN2RAB9AKDM4EMAPTHPGD
SCHEMBL11463673 0.85 SMN1; SMN2 (0.60) SMN1; SMN2RAB9AKDM4EMAPTHPGD
SCHEMBL11544615 0.85 MAPT (0.73) SMN1; SMN2RAB9AKDM4EMAPTHPGD
SCHEMBL385476 0.84 KDM4E (0.79) SMN1; SMN2RAB9AKDM4EMAPTHPGD
SCHEMBL385477 0.84 KDM4E (0.79) SMN1; SMN2RAB9AKDM4EMAPTHPGD
SCHEMBL29360251 0.84 KDM4E (0.79) SMN1; SMN2RAB9AKDM4EMAPTHPGD
SCHEMBL11341691 0.84 MAPT (0.85) SMN1; SMN2RAB9AKDM4EMAPTHPGD

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040238791-A1 Reinforcement of the effect of optical brighteners by means of polymers BASF AKTIENGESELLSCHAFT (DE) 2004-12-02 US disclosed