SCHEMBL7913221

SCHEMBL7913221

CCOC(=O)c1cc2c(nc1C)C(C)(C)CCC2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.50
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
CASP3 P42574 1/20 0.48
ATM Q13315 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
ACHE P22303 4/20 0.46
ALDH1A1 P00352 7/20 0.45
KMT2A Q03164 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
PPARG P37231 1/20 0.45
NCOR2 Q9Y618 1/20 0.45
ALOX15 P16050 1/20 0.43
MAPK1 P28482 1/20 0.43
HSD17B10 Q99714 1/20 0.42
TSHR P16473 1/20 0.42
HPGD P15428 3/20 0.41
GAA P10253 2/20 0.41

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
SCHEMBL2894638 0.89 KDM4E (0.49) KDM4ENPC1RAB9ACASP3ATM
SCHEMBL2894612 0.89 KDM4E (0.49) KDM4ENPC1RAB9ACASP3ATM
SCHEMBL2902646 0.81 KDM4E (0.45) KDM4ENPC1RAB9ACASP3ATM
SCHEMBL2902560 0.81 KDM4E (0.45) KDM4ENPC1RAB9ACASP3ATM
SCHEMBL7913070 0.77 KDM4E (0.75) KDM4ENPC1RAB9ACASP3ATM
SCHEMBL7910219 0.76 KDM4E (0.49) KDM4ENPC1RAB9ACASP3ATM
SCHEMBL7903030 0.76 KDM4E (0.73) KDM4ENPC1RAB9ACASP3ATM
SCHEMBL7902779 0.76 KDM4E (0.73) KDM4ENPC1RAB9ACASP3ATM
SCHEMBL7902939 0.75 KDM4E (0.51) KDM4ENPC1RAB9ACASP3ATM
SCHEMBL7903035 0.74 SLC9A1 (0.37) KDM4EALDH1A1SMN1; SMN2MAPK1LMNA

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