SCHEMBL6142135

SCHEMBL6142135

CCCCCc1nc2ccccc2n1CC

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.66
PKM P14618 1/20 0.66
KMT2A Q03164 1/20 0.66
GLA P06280 1/20 0.63
AGTR1 P30556 2/20 0.60
AGTR2 P50052 2/20 0.60
KDM4E B2RXH2 1/20 0.58
LMNA P02545 2/20 0.57
APEX1 P27695 1/20 0.57
MAPT P10636 1/20 0.57
TP53 P04637 1/20 0.56
TLR8 Q9NR97 1/20 0.55
TSHR P16473 1/20 0.55

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
SCHEMBL10325213 0.98 MEN1 (0.64) MEN1PKMKMT2AGLAAGTR1
SCHEMBL2361056 0.89 TP53 (0.69) MEN1KMT2AGLALMNAMAPT
SCHEMBL4739771 0.88 MEN1 (0.71) MEN1PKMKMT2AGLAAGTR1
SCHEMBL29968482 0.88 LMNA (0.67) GLAAGTR1AGTR2LMNAMAPT
SCHEMBL28860662 0.88 LMNA (0.67) GLAAGTR1AGTR2LMNAMAPT
SCHEMBL28716632 0.88 LMNA (0.67) GLAAGTR1AGTR2LMNAMAPT
SCHEMBL28878994 0.88 LMNA (0.67) GLAAGTR1AGTR2LMNAMAPT
SCHEMBL28879087 0.88 LMNA (0.67) GLAAGTR1AGTR2LMNAMAPT
SCHEMBL29968953 0.88 LMNA (0.67) GLAAGTR1AGTR2LMNAMAPT
SCHEMBL28879019 0.88 LMNA (0.67) GLAAGTR1AGTR2LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003027130-A2 TRANSITION METAL COMPLEXES FOR PREPARING OLEFIN OLIGOMERS EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2003-04-03 WO claimed
EP-1492746-A1 SELECTIVE COUPLING OF TERMINAL OLEFINS WITH ETHYLENE TO MANUFACTURE LINEAR ALPHA-OLEFINS ExxonMobil Research and Engineering Company (US) 2005-01-05 EP disclosed
WO-2003072529-A1 SELECTIVE COUPLING OF TERMINAL OLEFINS WITH ETHYLENE TO MANUFACTURE LINEAR ALPHA-OLEFINS EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2003-09-04 WO disclosed