SCHEMBL7910341

SCHEMBL7910341

CCOC(=O)c1cc2c(nc1C)/C(=C/c1ccccc1)CCCC2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.46
ALDH1A1 P00352 9/20 0.46
MAPK1 P28482 3/20 0.46
MAPT P10636 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
TP53 P04637 2/20 0.46
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 3/20 0.45
NPC1 O15118 2/20 0.45
CASP3 P42574 1/20 0.45
ATM Q13315 1/20 0.45
SENP8 Q96LD8 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
SENP6 Q9GZR1 1/20 0.45
RXFP1 Q9HBX9 1/20 0.44
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
HSP90AA1 P07900 1/20 0.43
HPGD P15428 4/20 0.43

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
SCHEMBL7910347 1.00 KDM4E (0.46) KDM4EALDH1A1MAPK1MAPTSMN1; SMN2
SCHEMBL7910349 1.00 KDM4E (0.46) KDM4EALDH1A1MAPK1MAPTSMN1; SMN2
SCHEMBL10899038 0.98 RAB9A (0.47) KDM4EALDH1A1MAPK1MAPTSMN1; SMN2
SCHEMBL10899031 0.98 RAB9A (0.47) KDM4EALDH1A1MAPK1MAPTSMN1; SMN2
SCHEMBL7902758 0.89 CYP19A1 (0.47) KDM4EALDH1A1MAPK1MAPTSMN1; SMN2
SCHEMBL7902752 0.89 CYP19A1 (0.47) KDM4EALDH1A1MAPK1MAPTSMN1; SMN2
SCHEMBL7902756 0.89 CYP19A1 (0.47) KDM4EALDH1A1MAPK1MAPTSMN1; SMN2
SCHEMBL10899381 0.85 NPC1 (0.44) KDM4EALDH1A1MAPK1MAPTSMN1; SMN2
SCHEMBL10899373 0.85 NPC1 (0.44) KDM4EALDH1A1MAPK1MAPTSMN1; SMN2
SCHEMBL10901276 0.81 RAB9A (0.44) KDM4EALDH1A1MAPK1MAPTSMN1; SMN2

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