SCHEMBL6863577

SCHEMBL6863577

[CH2]Sc1ccc(F)c(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36

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
SCHEMBL31372569 0.78 CES2 (0.39) CES2CES1
SCHEMBL6873080 0.77 CES2 (0.38) CES2CES1
SCHEMBL20850580 0.74 CES2 (0.36) CES2CES1
SCHEMBL6869512 0.74
SCHEMBL45430 0.72 CES2 (0.53) CES2CES1
SCHEMBL11355080 0.69 CES2 (0.50) CES2CES1
Ammonia Solution, Strong SCHEMBL3047305 0.69 CES2 (0.50) CES2CES1
Hydrazine SCHEMBL3793747 0.66 CES2 (0.48) CES2CES1
SCHEMBL14509380 0.66 CES2 (0.34) CES2CES1
Butadiene SCHEMBL9775438 0.65 CES2 (0.42) CES2CES1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1149094-B1 4-(AMINOALKOXY)BENZOFURANS AS N-MYRISTOYLTRANSFERASE INHIBITORS BASILEA PHARMACEUTICA AG (CH) 2004-04-21 EP disclosed
US-6376491-B1 BENZOFURAN DERIVATIVES FOR TREATMENT OR PREVENTION OF MYCOSIS IN MAMMALS BASILEA PHARMACEUTICA AG (CH) 2002-04-23 US disclosed
EP-1149094-A2 4-(AMINOALKOXY)BENZOFURANS AS N-MYRISTOYLTRANSFERASE INHIBITORS Basilea Pharmaceutica AG (CH) 2001-10-31 EP disclosed
WO-2000037464-A2 4-(AMINOALKOXY)BENZOFURANS AS N-MYRISTOYLTRANSFERASE INHIBITORS BASILEA PHARMACEUTICA AG (CH) 2000-06-29 WO disclosed