SCHEMBL7910336

SCHEMBL7910336

Cc1nc2c(cc1C=CC(=O)NC(=N)N)CCCCC2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 1/20 0.48
ALDH1A1 P00352 12/20 0.47
SMN1; SMN2 Q16637 10/20 0.47
MAPT P10636 10/20 0.47
LMNA P02545 8/20 0.47
MAPK1 P28482 3/20 0.47
HSP90AA1 P07900 1/20 0.47
TP53 P04637 2/20 0.45
HTT P42858 2/20 0.45
RAB9A P51151 8/20 0.43
NR2F2 P24468 1/20 0.43
ATM Q13315 1/20 0.43
KDM4E B2RXH2 8/20 0.40
NPC1 O15118 5/20 0.37
EEF2K O00418 1/20 0.37
POLB P06746 1/20 0.37
NFKB1 P19838 2/20 0.35
NFKB2 Q00653 2/20 0.35
RELA Q04206 2/20 0.35
PPARG P37231 1/20 0.34

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
SCHEMBL7916794 0.79 SLC9A1 (0.61) SLC9A1ALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL927184 0.79 SLC9A1 (0.61) SLC9A1ALDH1A1SMN1; SMN2MAPTLMNA
Maleic Acid SCHEMBL7916788 0.78 SLC9A1 (0.54) SLC9A1ALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL9837302 0.77 ALDH1A1 (0.56) SLC9A1ALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL9837306 0.77 ALDH1A1 (0.56) SLC9A1ALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL7912931 0.77 SLC9A1 (0.59) SLC9A1ALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL927181 0.71 ADRA2A (0.40) SLC9A1ALDH1A1SMN1; SMN2MAPTRAB9A
SCHEMBL7910316 0.71 SLC9A1 (0.49) SLC9A1ALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL7913104 0.71 KDM4E (0.45) SLC9A1ALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL7916722 0.71 SLC9A1 (0.45) SLC9A1ALDH1A1SMN1; SMN2MAPTLMNA

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