SCHEMBL14044006

SCHEMBL14044006

O=C(O)c1ccc(NCc2ccccc2CCc2ccccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
FFAR1 O14842 3/20 0.51
FFAR4 Q5NUL3 2/20 0.51
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
SYK P43405 3/20 0.49
HIF1A Q16665 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
KDM4E B2RXH2 1/20 0.48
LMNA P02545 1/20 0.48
RORC P51449 1/20 0.47
RAB9A P51151 1/20 0.47
GFER P55789 1/20 0.47
ALDH1A1 P00352 1/20 0.47
ADRB2 P07550 1/20 0.47

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
SCHEMBL6262049 0.86 CA1 (0.72) MEN1KMT2ACA1CA2HIF1A
SCHEMBL14044007 0.86 FFAR1 (0.69) FFAR1FFAR4CA1CA2HIF1A
SCHEMBL6258120 0.85 FFAR1 (0.49) MEN1KMT2AFFAR1FFAR4CA1
SCHEMBL6260082 0.84 TSHR (0.58) FFAR1ALDH1A1ADRB2
SCHEMBL1446643 0.82 CA1 (0.70) FFAR1FFAR4CA1CA2HIF1A
SCHEMBL14043636 0.82 HIF1A (0.62) FFAR1FFAR4CA1CA2HIF1A
SCHEMBL5273870 0.80 HIF1A (0.69) MEN1KMT2ACA1CA2SYK
SCHEMBL11259354 0.79 L3MBTL1 (0.63) FFAR1FFAR4CA1CA2SYK
SCHEMBL11248559 0.78 KMT2A (0.50) MEN1KMT2ACA1CA2HIF1A
SCHEMBL20897517 0.78 CYP1A2 (0.51) MEN1KMT2AFFAR1CA1CA2

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
WO-2008121570-A1 COMPOUNDS AND METHODS FOR MODULATING G PROTEIN-COUPLED RECEPTORS IRM LLC (BM) 2008-10-09 WO disclosed