SCHEMBL11068192

SCHEMBL11068192

Cc1c(N)cccc1COC1CCCCO1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.38
DHFR P00374 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TACR1 P25103 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
CYP3A4 P08684 1/20 0.34
TSHR P16473 1/20 0.34
PIK3CA P42336 1/20 0.34
CREBBP Q92793 2/20 0.33
EP300 Q09472 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
DCPS Q96C86 1/20 0.33
ICAM1 P05362 1/20 0.32
SELE P16581 1/20 0.32
ESR1 P03372 1/20 0.32
KCNH2 Q12809 1/20 0.32
KCNA5 P22460 1/20 0.31
SCN5A Q14524 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
SCHEMBL8760072 0.84 KDM4C (0.38) KDM4CDHFRMEN1KMT2ATACR1
SCHEMBL9442675 0.83 HTR6 (0.40) KDM4CDHFRMEN1KMT2ATACR1
SCHEMBL11068193 0.82 PDCD1 (0.37) KDM4CDHFRMEN1KMT2ACYP3A4
SCHEMBL18355699 0.81 TACR1 (0.46) KDM4CMEN1KMT2ATACR1NPC1
SCHEMBL7791898 0.81 KDM4C (0.43) KDM4CDHFRMEN1KMT2ATACR1
SCHEMBL8760058 0.81 KDM4C (0.36) KDM4CDHFRMEN1KMT2ATACR1
SCHEMBL8759396 0.81 MEN1 (0.36) KDM4CDHFRMEN1KMT2ATACR1
SCHEMBL9442671 0.81 KDM4C (0.36) KDM4CDHFRMEN1KMT2ATACR1
SCHEMBL11068837 0.79 TDP1 (0.42) KDM4CMEN1KMT2ATSHRL3MBTL1
SCHEMBL8887331 0.79 KDM4C (0.41) KDM4CDHFRMEN1KMT2ATACR1

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
US-4426524-A Heterocyclic substituted benzyl alcohol, insecticidal ester derivatives, and intermediates FMC CORPORATION (US) 1984-01-17 US disclosed