SCHEMBL8993255

SCHEMBL8993255

CCOC(=O)c1cnc2c(-c3ccc(Cc4cccc(OC)c4)c(OC)c3)cnn2c1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.50
RAB9A P51151 4/20 0.50
SMN1; SMN2 Q16637 4/20 0.48
MAPT P10636 4/20 0.48
NFKB1 P19838 2/20 0.48
NFKB2 Q00653 2/20 0.48
RELA Q04206 2/20 0.48
ALDH1A1 P00352 3/20 0.47
TP53 P04637 3/20 0.47
KDM4E B2RXH2 2/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
HPGD P15428 1/20 0.47
STAT1 P42224 1/20 0.47
HSD17B10 Q99714 1/20 0.47
GAA P10253 1/20 0.44
CSNK1D P48730 1/20 0.44
HCAR2 Q8TDS4 1/20 0.42
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39

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
SCHEMBL8993244 0.90 BRS3 (0.47) NPC1RAB9ASMN1; SMN2MAPTNFKB1
SCHEMBL8993226 0.89 NPC1 (0.54) NPC1RAB9ASMN1; SMN2MAPTNFKB1
SCHEMBL8993019 0.83 BRS3 (0.47) NPC1RAB9ASMN1; SMN2MAPTNFKB1
SCHEMBL8993100 0.83 NPC1 (0.53) NPC1RAB9ASMN1; SMN2MAPTNFKB1
SCHEMBL8992845 0.80 FYN (0.40) MAPTALDH1A1LMNAHCAR2MEN1
SCHEMBL8992903 0.80 FYN (0.40) MAPTALDH1A1LMNAHCAR2MEN1
SCHEMBL8992991 0.79 NPC1 (0.57) NPC1RAB9ASMN1; SMN2MAPTNFKB1
SCHEMBL8992780 0.78 BRS3 (0.54) NPC1RAB9ASMN1; SMN2MAPTNFKB1
SCHEMBL8992993 0.78 NPC1 (0.68) NPC1RAB9ASMN1; SMN2MAPTNFKB1
SCHEMBL11779261 0.77 NPC1 (0.66) NPC1RAB9ASMN1; SMN2MAPTNFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5516777-A PROSTATE CANCER THERAPY OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-05-14 US disclosed
US-5409928-A Prostate diseases, alopecia OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-04-25 US disclosed
EP-0594149-A2 Condensed pyrazole derivatives, method of manufacturing the same, and androgen inhibitor OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-04-27 EP disclosed