SCHEMBL8991138

SCHEMBL8991138

CNc1ncnc2c1c(C(N)=[Se])cn2Cc1ccc(OC)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.43
BCR P11274 1/20 0.43
HDAC1 Q13547 2/20 0.41
HDAC6 Q9UBN7 2/20 0.41
LMNA P02545 4/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPT P10636 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
TP53 P04637 3/20 0.38
HPGD P15428 2/20 0.38
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
AURKA O14965 2/20 0.37
RPS6KB1 P23443 2/20 0.37
ALOX15 P16050 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CHRM1 P11229 1/20 0.37

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
SCHEMBL8991063 0.88 GAA (0.41) HDAC1HDAC6LMNAALDH1A1MAPT
SCHEMBL8991388 0.87 PDE4A (0.50) LMNAALDH1A1MAPTSMN1; SMN2HPGD
SCHEMBL8991141 0.86 PDE4A (0.38) ABL1BCRHDAC1HDAC6TP53
SCHEMBL8991089 0.86 EGFR (0.45) ABL1HPGD
SCHEMBL8991143 0.81 HDAC1 (0.46) ABL1BCRHDAC1HDAC6LMNA
SCHEMBL8991047 0.79 ALDH1A1 (0.46) ABL1BCRHDAC1HDAC6LMNA
SCHEMBL8991225 0.77 PDE4A (0.42) ABL1ALDH1A1SMN1; SMN2HPGDPDE4A
SCHEMBL8991231 0.77 GAA (0.41) HDAC1HDAC6LMNAALDH1A1MAPT
SCHEMBL8991249 0.76 ADK (0.33)
SCHEMBL8991103 0.76 PDE4A (0.50) LMNAALDH1A1MAPTSMN1; SMN2HPGD

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
US-5543413-A VIRAL ACTIVITY AGAINST HUMAN CYTOMEGALOVIRUS AND HERPES SIMPLEX VIRUS REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1996-08-06 US disclosed