SCHEMBL2908703

SCHEMBL2908703

CCc1cncc(C2=NC(C)(C)Cc3ccccc32)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.46
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
APAF1 O14727 1/20 0.46
MITF O75030 1/20 0.46
TDP2 O95551 1/20 0.46
NSD2 O96028 1/20 0.46
MPI P34949 1/20 0.46
ATM Q13315 1/20 0.46
ALDH1A1 P00352 4/20 0.44
LMNA P02545 3/20 0.44
KMT2A Q03164 4/20 0.40
GAA P10253 2/20 0.40
PKM P14618 1/20 0.40
MEN1 O00255 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
CYP2D6 P10635 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL2914792 0.90 KDM4E (0.44) KDM4EMAPTSMN1; SMN2APAF1MITF
SCHEMBL2914499 0.83 KDM4E (0.49) KDM4EMAPTSMN1; SMN2APAF1MITF
SCHEMBL2914862 0.82 KDM4E (0.48) KDM4EMAPTSMN1; SMN2APAF1MITF
SCHEMBL2912119 0.79 MAPT (0.45) KDM4EMAPTSMN1; SMN2APAF1MITF
SCHEMBL2912081 0.78 KDM4E (0.44) KDM4EMAPTSMN1; SMN2APAF1MITF
SCHEMBL2914065 0.78 KDM4E (0.44) KDM4EMAPTSMN1; SMN2APAF1MITF
SCHEMBL2908134 0.78 KDM4E (0.47) KDM4EMAPTSMN1; SMN2APAF1MITF
SCHEMBL2905460 0.76 KDM4E (0.48) KDM4EMAPTSMN1; SMN2APAF1MITF
SCHEMBL2905923 0.75 KDM4E (0.49) KDM4EMAPTSMN1; SMN2APAF1MITF
SCHEMBL2913499 0.74 KDM4E (0.48) KDM4EMAPTSMN1; SMN2APAF1MITF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2223919-B1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND THEIR USE AS AGRICULTURAL AND HORTICULTURAL FUNGICIDES NIPPON SODA CO (JP) 2014-10-15 EP disclosed
EP-2223919-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND BACTERICIDE FOR AGRICULTURAL AND HORTICULTURAL USE Nippon Soda Co., Ltd. (JP) 2010-09-01 EP disclosed