SCHEMBL10673248

SCHEMBL10673248

CCCCOc1c(C(=O)Nc2ccccn2)c(=O)n2c3c(cccc13)CC2

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.64
RAB9A P51151 5/20 0.64
LMNA P02545 2/20 0.64
MAPT P10636 2/20 0.64
NPC1 O15118 1/20 0.64
ALDH1A1 P00352 6/20 0.54
PKM P14618 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.51
HTT P42858 2/20 0.51
POLB P06746 1/20 0.51
HPGD P15428 2/20 0.50
KMT2A Q03164 5/20 0.49
MEN1 O00255 4/20 0.49
ALOX12 P18054 1/20 0.49
HSD17B10 Q99714 1/20 0.48
MAPK1 P28482 1/20 0.47
RXFP1 Q9HBX9 1/20 0.46

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
SCHEMBL10675825 0.84 KDM4E (0.88) KDM4ERAB9ALMNAMAPTNPC1
SCHEMBL10680129 0.81 KDM4E (0.67) KDM4ERAB9ALMNAMAPTNPC1
SCHEMBL11285338 0.78 RAB9A (0.67) KDM4ERAB9ALMNAMAPTNPC1
SCHEMBL10676309 0.73 KDM4E (0.50) KDM4ERAB9ALMNAMAPTALDH1A1
SCHEMBL10676360 0.72 RAB9A (0.73) KDM4ERAB9ALMNAMAPTNPC1
SCHEMBL10679063 0.72 LMNA (0.60) KDM4ERAB9ALMNAMAPTNPC1
SCHEMBL25202670 0.71 AHR (0.64) KDM4ERAB9ALMNAMAPTNPC1
SCHEMBL30394094 0.71 AHR (0.64) KDM4ERAB9ALMNAMAPTNPC1
SCHEMBL10672432 0.69 KDM4E (0.63) KDM4ERAB9ALMNAMAPTNPC1
SCHEMBL10675616 0.67 LMNA (0.79) KDM4ERAB9ALMNAMAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4738971-A ENHANCED CELL-MEDIATED IMMUNITY; ANTIARTHRITIC AGENTS; NONTOXIC AKTIEBOLASET LEO (SE) 1988-04-19 US disclosed
US-4547511-A FOR ENHANCIN CELL-MEDIATED IMMUNITY AKTIEBOLAGET LEO (SE) 1985-10-15 US disclosed
EP-0059698-B1 HETEROCYCLIC CARBOXAMIDES, COMPOSITIONS CONTAINING SUCH COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND METHODS OF TREATMENT THEREWITH AB LEO (SE) 1985-09-25 EP disclosed
EP-0059698-A1 Heterocyclic carboxamides, compositions containing such compounds, processes for their preparation and methods of treatment therewith AB LEO (SE) 1982-09-08 EP disclosed