SCHEMBL8009506

SCHEMBL8009506

COc1cccc(C(OCc2ccccc2)C(=O)O)c1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 5/20 0.55
MTNR1B P49286 5/20 0.55
MAOB P27338 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
CASR P41180 1/20 0.50
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
USP2 O75604 1/20 0.46
MRGPRX4 Q96LA9 1/20 0.46
AOC3 Q16853 1/20 0.46
FFAR1 O14842 1/20 0.46

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
SCHEMBL18890298 0.86 MTNR1A (0.53) MTNR1AMTNR1BL3MBTL1CASR
SCHEMBL18890320 0.86 MTNR1A (0.53) MTNR1AMTNR1BL3MBTL1CASR
SCHEMBL5122883 0.84 CNR2 (0.54) L3MBTL1KMT2AAOC3FFAR1
SCHEMBL19714574 0.84 ATM (0.58) CASRKMT2ASMN1; SMN2AOC3
SCHEMBL18890091 0.84 L3MBTL1 (0.55) MTNR1AMTNR1BL3MBTL1AOC3FFAR1
SCHEMBL29393869 0.84 L3MBTL1 (0.55) MTNR1AMTNR1BL3MBTL1AOC3FFAR1
SCHEMBL17892023 0.84 ATM (0.58) CASRKMT2ASMN1; SMN2AOC3
SCHEMBL15610228 0.82 KYNU (0.50) KMT2ASMN1; SMN2
SCHEMBL21336450 0.82 CASR (0.52) MTNR1AMTNR1BMAOBL3MBTL1CASR
SCHEMBL18890297 0.82 CASR (0.52) MTNR1AMTNR1BMAOBL3MBTL1CASR

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-2000022909-A2 SYSTEMS FOR ORAL DELIVERY BIOTECH AUSTRALIA PTY. LIMITED (AU) 2000-04-27 WO disclosed