SCHEMBL28099224

SCHEMBL28099224

N#COc1cccc2cccnc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.53
RAB9A P51151 5/20 0.50
MAPT P10636 3/20 0.50
LMNA P02545 5/20 0.49
NPC1 O15118 4/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
MMP2 P08253 2/20 0.48
TSHR P16473 2/20 0.48
GMNN O75496 1/20 0.48
TP53 P04637 1/20 0.48
HSP90AA1 P07900 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
MMP9 P14780 1/20 0.48
ALOX15 P16050 1/20 0.48
NFKB1 P19838 1/20 0.48
MMP8 P22894 1/20 0.48
CCR1 P32246 1/20 0.48

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
SCHEMBL28233 0.81 KDM4E (0.53) KDM4ERAB9AMAPTLMNANPC1
SCHEMBL5802789 0.81 KDM4E (0.53) KDM4ERAB9AMAPTLMNANPC1
SCHEMBL10410895 0.79 KDM4E (0.50) KDM4ERAB9AMAPTLMNANPC1
SCHEMBL4316935 0.79 RAB9A (0.55) KDM4ERAB9AMAPTLMNANPC1
SCHEMBL6516869 0.79 KDM4E (0.58) KDM4ERAB9AMAPTLMNANPC1
SCHEMBL4386263 0.78 KDM4E (0.72) KDM4ERAB9AMAPTLMNANPC1
Water SCHEMBL10865815 0.77 MEN1 (0.66) KDM4ERAB9AMAPTLMNANPC1
Water SCHEMBL29366671 0.77 KDM4E (0.56) KDM4ERAB9AMAPTLMNANPC1
Hydrochloric Acid SCHEMBL27496748 0.76 KDM4E (0.59) KDM4ERAB9AMAPTLMNANPC1
SCHEMBL28188530 0.75 LMNA (0.55) KDM4ERAB9AMAPTLMNAMEN1

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
CN-103529665-B Electrophotographic photosensitive element, handle box and electronic photographing device 佳能株式会社 2016-11-02 CN disclosed