SCHEMBL7911328

SCHEMBL7911328

Cc1nc2c(cc1C(=O)NC(=N)N)CCC/C2=N\O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 1/20 0.39
MAPT P10636 4/20 0.32
SMN1; SMN2 Q16637 4/20 0.32
LMNA P02545 2/20 0.32
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 3/20 0.31
NPC1 O15118 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
NR2F2 P24468 1/20 0.31
ATM Q13315 1/20 0.31
PLAU P00749 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
SCHEMBL7911332 1.00 SLC9A1 (0.39) SLC9A1MAPTSMN1; SMN2LMNAALDH1A1
SCHEMBL7910302 0.88 SLC9A1 (0.37) SLC9A1MAPTSMN1; SMN2LMNAALDH1A1
SCHEMBL7910297 0.88 SLC9A1 (0.37) SLC9A1MAPTSMN1; SMN2LMNAALDH1A1
SCHEMBL7913231 0.82 SLC9A1 (0.41) SLC9A1MAPTSMN1; SMN2LMNAALDH1A1
SCHEMBL7910240 0.79 ACHE (0.44) SLC9A1MAPTSMN1; SMN2LMNAALDH1A1
SCHEMBL7910243 0.79 ACHE (0.44) SLC9A1MAPTSMN1; SMN2LMNAALDH1A1
SCHEMBL7903042 0.79 SLC9A1 (0.39) SLC9A1MAPTSMN1; SMN2LMNAALDH1A1
SCHEMBL7912931 0.78 SLC9A1 (0.59) SLC9A1MAPTSMN1; SMN2LMNAALDH1A1
SCHEMBL927184 0.77 SLC9A1 (0.61) SLC9A1MAPTSMN1; SMN2LMNAALDH1A1
SCHEMBL7916794 0.77 SLC9A1 (0.61) SLC9A1MAPTSMN1; SMN2LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6258829-B1 ANTIARRTHMIA AGENTS AND CARDIOVASCULAR DISORDERS TOA EIYO LTD. (JP) 2001-07-10 US disclosed
EP-0972767-A1 CYCLOALKA[b]PYRIDINE-3-CARBONYLGUANIDINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND DRUGS CONTAINING THE SAME TOA EIYO LTD. (JP) 2000-01-19 EP disclosed