SCHEMBL6704664

SCHEMBL6704664

COC(=O)Cn1c(C(=O)Nc2nc(-c3cc(OC)c(Cl)cc3OC)c(C(C)C3CCCCC3)s2)cc2cc(C)c(C)cc21

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SAE1 Q9UBE0 1/20 0.33
MAPT P10636 3/20 0.33
LMNA P02545 2/20 0.33
TP53 P04637 1/20 0.33
KDM4E B2RXH2 3/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
STAT3 P40763 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HTT P42858 2/20 0.31
ROCK2 O75116 3/20 0.31
TSHR P16473 2/20 0.31
F10 P00742 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CHRM4 P08173 1/20 0.31
NPC1 O15118 1/20 0.30
CASP3 P42574 1/20 0.30
RAB9A P51151 1/20 0.30
SENP7 Q9BQF6 1/20 0.30
PI4KB Q9UBF8 2/20 0.30

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
SCHEMBL6704665 0.94 CHRM4 (0.33) SAE1MAPTLMNATP53KDM4E
SCHEMBL6703723 0.92 F10 (0.36) MAPTLMNATP53ALDH1A1F10
SCHEMBL7679713 0.90 MEN1 (0.40) F10
SCHEMBL6705251 0.90 SAE1 (0.34) SAE1MAPTLMNATP53KDM4E
SCHEMBL6702286 0.90 MAPT (0.32) SAE1MAPTLMNATP53KDM4E
SCHEMBL6703652 0.87 MEN1 (0.38) MAPTLMNATP53KDM4EALDH1A1
SCHEMBL6702438 0.86 MAPT (0.38) MAPTLMNATP53KDM4EALDH1A1
SCHEMBL7688738 0.85 MEN1 (0.46) F10
SCHEMBL6704667 0.85 TRPV4 (0.33) SAE1MAPTLMNATP53ALDH1A1
SCHEMBL6704409 0.84 MAPT (0.32) SAE1MAPTLMNATP53KDM4E

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