SCHEMBL11765846

SCHEMBL11765846

O=C(CC=Cc1ccccc1)OC/C=C/c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAM P19021 1/20 0.61
MMP1 P03956 1/20 0.52
MMP2 P08253 1/20 0.52
MMP9 P14780 1/20 0.52
MMP12 P39900 1/20 0.52
IDO1 P14902 2/20 0.52
MAOB P27338 4/20 0.51
CACNA1B Q00975 2/20 0.47
MAOA P21397 3/20 0.46
ALDH1A1 P00352 2/20 0.45
MAPT P10636 2/20 0.45
RECQL P46063 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
LMNA P02545 2/20 0.44
CYP4F2 P78329 1/20 0.43
CYP4A11 Q02928 1/20 0.43
HDAC3 O15379 1/20 0.42
TNKS O95271 1/20 0.42
HDAC4 P56524 1/20 0.42

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
SCHEMBL7260054 0.91 PAM (0.51) PAMMMP1MMP2MMP9MMP12
SCHEMBL28906310 0.88 PAM (0.56) PAMMMP1MMP2MMP9MMP12
SCHEMBL27509127 0.87 MMP1 (0.54) PAMMMP1MMP2MMP9MMP12
SCHEMBL9518796 0.87 MMP1 (0.54) PAMMMP1MMP2MMP9MMP12
SCHEMBL27760105 0.86 MMP1 (0.52) PAMMMP1MMP2MMP9MMP12
SCHEMBL10891882 0.86 PAM (0.61) PAMMAOBMAOAALDH1A1MAPT
SCHEMBL10891880 0.86 PAM (0.61) PAMMAOBMAOAALDH1A1MAPT
SCHEMBL11765851 0.84 PAM (0.47) PAMMMP1MMP2MMP9MMP12
SCHEMBL23707003 0.84 MMP1 (0.51) PAMMMP1MMP2MMP9MMP12
SCHEMBL10617735 0.84 IDO1 (0.55) PAMMMP1MMP2MMP9MMP12

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-4025547-A LIGAND STABILIZED PALLADIUM HALIDE-GROUP 4 HALIDE CATALYST TEXACO INC. (US) 1977-05-24 US claimed