SCHEMBL20114355

SCHEMBL20114355

c1ccc(-c2cccc(N3c4ccccc4Oc4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 2/20 0.35
HTT P42858 2/20 0.35
FAAH O00519 1/20 0.35
HSP90AA1 P07900 1/20 0.35
PKM P14618 1/20 0.35
MGLL Q99685 1/20 0.35
EDNRA P25101 7/20 0.34
EDNRB P24530 3/20 0.34
TSPO P30536 2/20 0.34
HDAC4 P56524 1/20 0.34
DNM1 Q05193 1/20 0.32
KMT2A Q03164 2/20 0.32
IL1R1 P14778 1/20 0.32
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
PTGER4 P35408 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
SCHEMBL20114207 0.99 ATM (0.40) ATML3MBTL1KDM4EALDH1A1HTT
SCHEMBL20114199 0.98 ATM (0.38) ATML3MBTL1KDM4EALDH1A1HTT
SCHEMBL20114123 0.95 ATM (0.38) ATML3MBTL1KDM4EALDH1A1HTT
SCHEMBL20114592 0.95 ATM (0.38) ATML3MBTL1KDM4EALDH1A1HTT
SCHEMBL20114184 0.94 EDNRA (0.38) ATML3MBTL1KDM4EALDH1A1HTT
SCHEMBL20114040 0.94 L3MBTL1 (0.42) ATML3MBTL1KDM4EALDH1A1HTT
SCHEMBL15470144 0.94 L3MBTL1 (0.42) ATML3MBTL1KDM4EALDH1A1HTT
SCHEMBL20114090 0.94 L3MBTL1 (0.42) ATML3MBTL1KDM4EALDH1A1HTT
SCHEMBL20114068 0.93 L3MBTL1 (0.40) ATML3MBTL1KDM4EALDH1A1FAAH
SCHEMBL10309959 0.93 L3MBTL1 (0.43) ATML3MBTL1KDM4EALDH1A1EDNRA

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
WO-2018080067-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING SAME 주식회사 두산 2018-05-03 WO disclosed