SCHEMBL8327201

SCHEMBL8327201

Cc1noc2c(Cc3ncccc3C(=O)NCc3ccc(C(C)(C)O)cc3)cccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.42
NSD2 O96028 1/20 0.42
HDAC6 Q9UBN7 1/20 0.41
AKR1C3 P42330 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
KMT2A Q03164 2/20 0.37
POLB P06746 2/20 0.37
MT-CO2 P00403 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
LMNA P02545 1/20 0.37
PDPK1 O15530 1/20 0.36
GAA P10253 1/20 0.36
HPGDS O60760 1/20 0.36
MAPT P10636 2/20 0.36
ESR1 P03372 1/20 0.36
MAPK10 P53779 1/20 0.36
NAMPT P43490 1/20 0.36

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
SCHEMBL7367374 0.82 HPGD (0.48) HPGDNSD2AKR1C3SMN1; SMN2LMNA
SCHEMBL7370504 0.73 MAPK8 (0.50) HPGDSMN1; SMN2LMNAGAA
SCHEMBL7847928 0.71 HPGD (0.55) HPGDHDAC6CYP1A2CYP2C19KMT2A
SCHEMBL7370502 0.67 MAPK8 (0.62) HPGDCYP1A2CYP2C19KMT2ASMN1; SMN2
SCHEMBL12844507 0.66 NSD2 (0.63) HPGDNSD2KMT2ALMNAGAA
SCHEMBL8376695 0.66 HPGD (0.61) HPGDNSD2HDAC6CYP1A2CYP3A4
SCHEMBL7366732 0.66 HPGD (0.61) HPGDKMT2APOLBSMN1; SMN2LMNA
SCHEMBL7373017 0.66 MAPK8 (0.60) HPGDKMT2APOLBSMN1; SMN2LMNA
SCHEMBL7399781 0.66 MAPK8 (0.57) HPGDKMT2ASMN1; SMN2LMNA
SCHEMBL7365200 0.65 MAPK8 (0.62) HPGDSMN1; SMN2LMNAMAPTNAMPT

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
WO-2004047817-A1 PDE4 AND PDE3/4 INHIBITORS FOR USE IN THE TREATMENT OF CACHEXIA ALTANA PHARMA AG (DE) 2004-06-10 WO disclosed