SCHEMBL9847537

SCHEMBL9847537

COCCOCCc1cccnc1-c1ncccc1CCOCCOC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.47
HCAR2 Q8TDS4 4/20 0.36
KDM4E B2RXH2 2/20 0.34
NPC1 O15118 1/20 0.34
ALOX12 P18054 1/20 0.34
HTT P42858 1/20 0.34
RAB9A P51151 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ADRA1A P35348 1/20 0.34
TSHR P16473 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 1/20 0.33
PKM P14618 1/20 0.33
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
POLB P06746 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
DPP4 P27487 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
SCHEMBL9847539 0.77 KDM4E (0.34) MYCKDM4ENPC1HTTRAB9A
SCHEMBL16081692 0.76 KDM4E (0.42) MYCKDM4ENPC1HTTRAB9A
SCHEMBL31342417 0.76 HDAC1 (0.39) KDM4ENPC1ALOX12HTTRAB9A
SCHEMBL29436004 0.75 CA12 (0.49) NPC1RAB9AALDH1A1
SCHEMBL25273539 0.74 P2RX7 (0.40) MYCKDM4ENPC1ALOX12HTT
SCHEMBL27516004 0.74 TAAR1 (0.48) HCAR2KDM4ETSHRALDH1A1HPGD
SCHEMBL10694333 0.73 TSHR (0.38) KDM4ETSHRALDH1A1HPGDSMN1; SMN2
SCHEMBL18837847 0.73 TAAR1 (0.47) KDM4ENPC1RAB9ATSHRALDH1A1
SCHEMBL3638776 0.73 BACE1 (0.47) MYCKDM4ENPC1ALOX12HTT
SCHEMBL23534195 0.73 ADRA1A (0.40) MYCHCAR2KDM4ENPC1ALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0411935-A2 Copper radio sensitizers JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 1991-02-06 EP disclosed