SCHEMBL8553233

SCHEMBL8553233

[CH2]CC=C(c1ccc(F)cc1)c1ccc(F)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
MAOA P21397 2/20 0.41
MAOB P27338 2/20 0.41
PTPN1 P18031 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
PTGS2 P35354 1/20 0.38
TBXAS1 P24557 1/20 0.38
BCL2L1 Q07817 1/20 0.37
BAD Q92934 1/20 0.37
TNFRSF1A P19438 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
SCHEMBL10967132 0.92 PTGS2 (0.44) NPC1RAB9APTGS2TBXAS1
SCHEMBL8675717 0.85 TBXAS1 (0.41) CES2CES1MAOAMAOBPTPN1
SCHEMBL27629299 0.80 MAOB (0.41) CES2CES1MAOAMAOBPTPN1
SCHEMBL9377885 0.79 PTPN1 (0.48) CES2CES1MAOAMAOBPTPN1
SCHEMBL5674623 0.79 CES2 (0.41) CES2CES1MAOAMAOBPTPN1
SCHEMBL9199309 0.79 HTR7 (0.42) CES2CES1PTPN1NPC1RAB9A
SCHEMBL5268885 0.78 MTNR1A (0.47) TBXAS1
SCHEMBL4285163 0.76 CES2 (0.48) CES2CES1PTPN1NPC1RAB9A
SCHEMBL7413792 0.76 PTPN1 (0.45) CES2CES1MAOAMAOBPTPN1
SCHEMBL11994159 0.76 POLB (0.49) CES2CES1PTPN1PTGS2TBXAS1

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-0816362-A1 THIAZOLE DERIVATIVES TAISHO PHARMACEUTICAL CO. LTD (JP) 1998-01-07 EP disclosed