SCHEMBL7246151

SCHEMBL7246151

COC(=O)c1cc(-c2cc(-c3ccccc3)cs2)c(OC)s1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.44
C1S P09871 1/20 0.44
OPRD1 P41143 1/20 0.43
ALDH1A1 P00352 10/20 0.41
HPGD P15428 8/20 0.41
LMNA P02545 4/20 0.41
MAPT P10636 4/20 0.41
GAA P10253 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
PRKCZ Q05513 1/20 0.41
KDM4E B2RXH2 4/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
EGFR P00533 1/20 0.39
HDAC6 Q9UBN7 1/20 0.38
GRM6 O15303 1/20 0.38
GRM5 P41594 1/20 0.38
HSD17B10 Q99714 3/20 0.37
GLA P06280 1/20 0.37
TSHR P16473 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
SCHEMBL6924288 0.78 C1S (0.71) PLAUC1SALDH1A1MAPTMEN1
SCHEMBL2326735 0.76 HDAC6 (0.57) ALDH1A1HPGDLMNAMAPTGAA
SCHEMBL12396903 0.71 OPRD1 (0.73) OPRD1ALDH1A1HPGDLMNAMAPT
SCHEMBL14234477 0.70 ALDH1A1 (0.56) OPRD1ALDH1A1HPGDLMNAMAPT
SCHEMBL2325062 0.70 OPRD1 (0.51) OPRD1ALDH1A1HPGDLMNAMAPT
SCHEMBL6928117 0.68 PLAU (0.61) PLAUC1SOPRD1ALDH1A1HPGD
SCHEMBL10088561 0.68 OPRD1 (0.49) OPRD1ALDH1A1HPGDLMNAMAPT
SCHEMBL2323109 0.68 L3MBTL1 (0.53) PLAUC1SOPRD1ALDH1A1HPGD
SCHEMBL2328247 0.67 OPRD1 (0.51) OPRD1ALDH1A1HPGDLMNAMAPT
SCHEMBL829766 0.67 SLC9A1 (0.60) ALDH1A1HPGDLMNAKDM4EL3MBTL1

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-6562840-B1 Non-peptidic inhibitors of proteolytic enzymes such as urokinase 3-DIMENSIONAL PHARMACEUTICALS, INC. 2003-05-13 US disclosed