SCHEMBL8309995

SCHEMBL8309995

[NH]CCNCCN1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.48
PRMT6 Q96LA8 1/20 0.48
PRMT8 Q9NR22 1/20 0.48
SIGMAR1 Q99720 3/20 0.47
ACE2 Q9BYF1 1/20 0.46
DPP7 Q9UHL4 2/20 0.44
CA12 O43570 3/20 0.42
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
CA9 Q16790 3/20 0.42
HRH3 Q9Y5N1 1/20 0.42
KDM1A O60341 1/20 0.41
NPC1 O15118 1/20 0.37
SCN5A Q14524 1/20 0.37
ALDH1A1 P00352 2/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL8308208 0.98 CARM1 (0.50) CARM1PRMT6PRMT8SIGMAR1ACE2
SCHEMBL4288469 0.88 CARM1 (0.59) CARM1PRMT6PRMT8SIGMAR1ACE2
SCHEMBL31326654 0.88 CARM1 (0.59) CARM1PRMT6PRMT8SIGMAR1ACE2
SCHEMBL8308930 0.87 ACE2 (0.48) CARM1PRMT6PRMT8SIGMAR1ACE2
SCHEMBL8307197 0.87 HRH3 (0.50) CARM1PRMT6PRMT8SIGMAR1ACE2
SCHEMBL10410535 0.85 CARM1 (0.62) CARM1PRMT6PRMT8SIGMAR1ACE2
SCHEMBL8310657 0.84 SCN5A (0.46) CARM1PRMT6PRMT8SIGMAR1ACE2
SCHEMBL8309186 0.84 ACE2 (0.50) CARM1PRMT6PRMT8SIGMAR1ACE2
SCHEMBL22788741 0.83 CARM1 (0.59) CARM1PRMT6PRMT8SIGMAR1ACE2
SCHEMBL17528553 0.83 CARM1 (0.59) CARM1PRMT6PRMT8SIGMAR1ACE2

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-0790986-B1 ANILINE DERIVATIVES ZENECA LTD (GB) 1999-01-20 EP disclosed