SCHEMBL7911317

SCHEMBL7911317

CN(C)Cc1nc2c(cc1C(=O)NC(=N)N)CCCCC2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 1/20 0.43
KDM4E B2RXH2 7/20 0.40
SMN1; SMN2 Q16637 10/20 0.35
RAB9A P51151 9/20 0.35
NPC1 O15118 7/20 0.35
ALDH1A1 P00352 9/20 0.35
POLB P06746 5/20 0.35
EEF2K O00418 1/20 0.35
KMT2A Q03164 2/20 0.35
PPARG P37231 1/20 0.35
NCOR2 Q9Y618 1/20 0.35
MAPT P10636 9/20 0.33
LMNA P02545 5/20 0.33
TP53 P04637 4/20 0.33
HTT P42858 3/20 0.33
HPGD P15428 2/20 0.33
RECQL P46063 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL7913104 0.87 KDM4E (0.45) SLC9A1KDM4ESMN1; SMN2RAB9ANPC1
SCHEMBL926631 0.86 SLC9A1 (0.43) SLC9A1KDM4ESMN1; SMN2RAB9ANPC1
SCHEMBL7913003 0.85 SLC9A1 (0.43) SLC9A1KDM4ESMN1; SMN2RAB9ANPC1
SCHEMBL7912966 0.84 KDM4E (0.43) SLC9A1KDM4ESMN1; SMN2RAB9ANPC1
SCHEMBL927184 0.81 SLC9A1 (0.61) SLC9A1KDM4ESMN1; SMN2RAB9ANPC1
SCHEMBL7916794 0.81 SLC9A1 (0.61) SLC9A1KDM4ESMN1; SMN2RAB9ANPC1
SCHEMBL7912931 0.79 SLC9A1 (0.59) SLC9A1KDM4ESMN1; SMN2RAB9ANPC1
SCHEMBL927564 0.79 KDM4E (0.38) SLC9A1KDM4ESMN1; SMN2RAB9ANPC1
SCHEMBL7916809 0.78 SLC9A1 (0.45) SLC9A1KDM4ESMN1; SMN2RAB9ANPC1
SCHEMBL927183 0.78 SLC9A1 (0.45) SLC9A1KDM4ESMN1; SMN2RAB9ANPC1

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