SCHEMBL7189037

SCHEMBL7189037

CCOC(=O)CCc1ccc(Oc2c(-c3ccc(Cl)cc3)ccc3cc(OC)ccc23)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.43
CYP4A11 Q02928 1/20 0.43
MAPT P10636 4/20 0.41
LMNA P02545 3/20 0.41
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 2/20 0.41
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
TP53 P04637 1/20 0.41
MAOA P21397 1/20 0.41
SLC6A2 P23975 1/20 0.41
RAB9A P51151 1/20 0.41
SLC6A3 Q01959 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
BRD4 O60885 3/20 0.41
FFAR1 O14842 2/20 0.40
FFAR4 Q5NUL3 1/20 0.40
ALDH1A1 P00352 3/20 0.39
PTPN11 Q06124 1/20 0.39

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
SCHEMBL7189999 0.94 CYP4F2 (0.46) CYP4F2CYP4A11MAPTLMNACYP1A2
SCHEMBL7195159 0.91 ESR1 (0.44) CYP4F2CYP4A11KDM4EFFAR1FFAR4
SCHEMBL7181142 0.91 CYP4F2 (0.43) CYP4F2CYP4A11MAPTLMNACYP1A2
SCHEMBL7193820 0.89 ALOX5 (0.42) CYP4F2CYP4A11MAPTLMNACYP1A2
SCHEMBL7183696 0.88 FFAR1 (0.51) MAPTLMNACYP1A2CYP3A4KDM4E
SCHEMBL7194279 0.88 CYP1A2 (0.47) CYP4F2CYP4A11MAPTLMNACYP1A2
SCHEMBL7190395 0.85 CYP1A2 (0.42) CYP4F2CYP4A11MAPTLMNACYP1A2
SCHEMBL7194188 0.84 ESR1 (0.45) CYP4F2CYP4A11MAPTLMNACYP1A2
SCHEMBL7195351 0.84 MAPT (0.47) CYP4F2CYP4A11MAPTLMNAKDM4E
SCHEMBL7193207 0.84 ESR1 (0.49) CYP4F2CYP4A11KDM4EMAOAALDH1A1

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
EP-0835867-B1 1-Aryloxy-2-arylnaphthyl compounds, intermediates, compositions, and methods LILLY CO ELI (US) 2003-12-03 EP claimed