SCHEMBL11267074

SCHEMBL11267074

O=C(O)CCCCCn1c(-c2ccccc2)c[nH]c1=O

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 2/20 0.54
FABP5 Q01469 2/20 0.54
PTGIR P43119 4/20 0.49
KDM4E B2RXH2 2/20 0.46
HSD17B10 Q99714 2/20 0.46
MAPK1 P28482 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TBXAS1 P24557 2/20 0.45
MEN1 O00255 1/20 0.43
GLA P06280 1/20 0.43
KMT2A Q03164 1/20 0.43
CCNT1 O60563 1/20 0.43
CDK9 P50750 1/20 0.43
PTGS1 P23219 4/20 0.43
PTGS2 P35354 4/20 0.43
TSHR P16473 1/20 0.43
APEX1 P27695 1/20 0.42

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
SCHEMBL11258884 1.00 FABP4 (0.54) FABP4FABP5PTGIRKDM4EHSD17B10
SCHEMBL11255610 1.00 FABP4 (0.54) FABP4FABP5PTGIRKDM4EHSD17B10
SCHEMBL11255916 1.00 FABP4 (0.54) FABP4FABP5PTGIRKDM4EHSD17B10
SCHEMBL11125777 0.99 FABP4 (0.52) FABP4FABP5PTGIRKDM4EHSD17B10
SCHEMBL11246384 0.88 ALDH1A1 (0.47) FABP4FABP5KDM4EHSD17B10ALDH1A1
SCHEMBL11125773 0.88 HDAC1 (0.41) FABP4FABP5PTGIRKDM4EHSD17B10
SCHEMBL11259084 0.84 KDM4E (0.48) FABP4FABP5KDM4EHSD17B10ALDH1A1
SCHEMBL11268888 0.81 FABP4 (0.52) FABP4FABP5KDM4EHSD17B10MAPK1
SCHEMBL11256522 0.76 PDE4A (0.41) FABP4FABP5KDM4EHSD17B10ALDH1A1
SCHEMBL11123799 0.76 PTGIR (0.50) FABP4FABP5PTGIRKDM4EALDH1A1

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
US-4330550-A ANTICOAGULANTS AND ANALGESICS A. NATTERMANN & CIE. GMBH (DE) 1982-05-18 US claimed