SCHEMBL6911986

SCHEMBL6911986

Cc1cccc(C)c1/N=C/c1cccc(/C=N/C(C)(C)C)n1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
ALDH1A1 P00352 1/20 0.33
PLA2G1B P04054 1/20 0.33
ATG4B Q9Y4P1 1/20 0.33
CNR2 P34972 4/20 0.32
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
CTH P32929 1/20 0.31
KDM4E B2RXH2 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL6911990 1.00 MAPT (0.33) MAPTALDH1A1PLA2G1BATG4BCNR2
SCHEMBL6907852 0.89 MEN1 (0.31) MAPTCNR2MEN1NPC1RAB9A
SCHEMBL6907849 0.89 MEN1 (0.31) MAPTCNR2MEN1NPC1RAB9A
SCHEMBL6910964 0.89 ALDH1A1 (0.33) MAPTALDH1A1PLA2G1BATG4BMEN1
SCHEMBL6910961 0.89 ALDH1A1 (0.33) MAPTALDH1A1PLA2G1BATG4BMEN1
SCHEMBL5589354 0.88 CTH (0.36) MAPTALDH1A1PLA2G1BATG4BMEN1
SCHEMBL5589346 0.88 CTH (0.36) MAPTALDH1A1PLA2G1BATG4BMEN1
SCHEMBL5693787 0.86 CTH (0.35) MAPTALDH1A1PLA2G1BATG4BMEN1
SCHEMBL5587761 0.86 CTH (0.35) MAPTALDH1A1PLA2G1BATG4BMEN1
Hydrochloric Acid SCHEMBL7177279 0.84 NR4A1 (0.36) ALDH1A1MEN1NPC1RAB9AKMT2A

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-2004074333-A2 PROCESS FOR HOMO- OR COPOLYMERIZATIONOF CONJUGATED OLEFINES DOW GLOBAL TECHNOLOGIES INC. (US) 2004-09-02 WO disclosed