SCHEMBL6703370

SCHEMBL6703370

COC(=O)c1cccc(Cn2c(C(=O)O)cc3c(C)c(C)ccc32)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F10 P00742 9/20 0.51
CCR2 P41597 4/20 0.49
F2 P00734 1/20 0.46
MAPT P10636 2/20 0.46
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.46
PKM P14618 1/20 0.46
RHEB Q15382 1/20 0.46
LOXL2 Q9Y4K0 1/20 0.45
THRB P10828 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ABHD6 Q9BV23 1/20 0.44
CYP4F2 P78329 1/20 0.44
CYP4A11 Q02928 1/20 0.44

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
SCHEMBL6703005 0.85 F10 (0.54) F10F2
SCHEMBL14122151 0.81 TDP1 (0.59) MAPTALDH1A1GAAPKMTHRB
SCHEMBL6703954 0.77 CCR2 (0.47) F10CCR2MAPTGAALOXL2
SCHEMBL6703577 0.75 HSD17B10 (0.48) CCR2MAPTALDH1A1GAASMN1; SMN2
SCHEMBL14121922 0.72 TDP1 (0.56) F10MAPTALDH1A1GAA
SCHEMBL6435704 0.71 F10 (0.73) F10CCR2F2
SCHEMBL12822646 0.71 FOLH1 (0.52) F10
SCHEMBL12822364 0.70 F10 (0.55) F10LOXL2ABHD6CYP4F2CYP4A11
SCHEMBL30417904 0.70 F10 (0.55) F10LOXL2ABHD6CYP4F2CYP4A11
SCHEMBL8762311 0.69 MAPK8 (0.48) F10LOXL2

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-20040198793-A1 Chemical process and new intermediates SANOFI-SYNTHELABO (FR) 2004-10-07 US disclosed
EP-1345897-A1 CHEMICAL PROCESS AND NEW INTERMEDIATES SANOFI-SYNTHELABO (FR) 2003-09-24 EP disclosed
WO-2002044150-A1 CHEMICAL PROCESS AND NEW INTERMEDIATES SANOFI-SYNTHELABO (FR) 2002-06-06 WO disclosed