SCHEMBL8665033

SCHEMBL8665033

CCCC(O)c1cc2cccnc2n1Oc1c(C)cc(-c2nnn(C)n2)cc1C

nearest known ligand 0.30

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GLA P06280 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 1/20 0.30
NPC1 O15118 1/20 0.30
NFKB1 P19838 1/20 0.30
RAB9A P51151 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
ALOX5 P09917 1/20 0.30
TYK2 P29597 1/20 0.30

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
SCHEMBL8665035 0.70 RIPK1 (0.34) KDM4EALDH1A1GLAGAAMAPT
SCHEMBL8555476 0.70
SCHEMBL8922263 0.69 NR1I2 (0.33) KDM4EALDH1A1GLAGAAMAPT
SCHEMBL8555459 0.69
SCHEMBL8665484 0.67 KDM4E (0.31) KDM4EALDH1A1GLAGAAMAPT
SCHEMBL8668162 0.67 KDM2B (0.32) ALDH1A1NPC1NFKB1RAB9ANFKB2
SCHEMBL8555468 0.64 L3MBTL1 (0.33) KDM4EALDH1A1GAAMAPTHSD17B10
SCHEMBL8557108 0.64 L3MBTL1 (0.31) NPC1NFKB1RAB9ANFKB2RELA
SCHEMBL8925600 0.63 CCNE1 (0.37) ALDH1A1TYK2
SCHEMBL8992121 0.62 BRD4 (0.37) KDM4EALDH1A1GLAGAAMAPT

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-5763461-A ANTIPICORNAVIRAL AGENTS SANOFI (FR) 1998-06-09 US disclosed