SCHEMBL5693787

SCHEMBL5693787

Cc1cccc(C)c1/N=C/c1cccc(/C=N/c2c(C)cccc2C)n1.[Co]

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTH P32929 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HSP90AA1 P07900 1/20 0.34
ATM Q13315 1/20 0.34
KDM4E B2RXH2 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
NR4A1 P22736 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
GAA P10253 1/20 0.33
MAOA P21397 1/20 0.32
ALDH1A1 P00352 5/20 0.32
CYP3A4 P08684 2/20 0.32
CYP2D6 P10635 2/20 0.32
CYP1A2 P05177 2/20 0.32
ALOX15 P16050 1/20 0.32
NPC1 O15118 1/20 0.32
GRM5 P41594 1/20 0.32
RAB9A P51151 1/20 0.32
GRM4 Q14833 1/20 0.32

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
SCHEMBL5587761 1.00 CTH (0.35) CTHMEN1KMT2AHSP90AA1ATM
SCHEMBL5589354 0.98 CTH (0.36) CTHMEN1KMT2AHSP90AA1ATM
SCHEMBL5589346 0.98 CTH (0.36) CTHMEN1KMT2AHSP90AA1ATM
Hydrochloric Acid SCHEMBL7179444 0.94 NR4A1 (0.36) CTHMEN1KMT2AHSP90AA1ATM
Hydrochloric Acid SCHEMBL7171706 0.94 NR4A1 (0.36) CTHMEN1KMT2AHSP90AA1ATM
Hydrochloric Acid SCHEMBL7176698 0.94 NR4A1 (0.36) CTHMEN1KMT2AHSP90AA1ATM
Hydrochloric Acid SCHEMBL7174410 0.94 NR4A1 (0.36) CTHMEN1KMT2AHSP90AA1ATM
Hydrochloric Acid SCHEMBL7176751 0.94 NR4A1 (0.36) CTHMEN1KMT2AHSP90AA1ATM
Hydrochloric Acid SCHEMBL7177279 0.94 NR4A1 (0.36) CTHMEN1KMT2AHSP90AA1ATM
Hydrochloric Acid SCHEMBL7181267 0.94 NR4A1 (0.36) CTHMEN1KMT2AHSP90AA1ATM

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
EP-1521758-B1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEM PATENTS INC (US) 2006-05-24 EP claimed