SCHEMBL27996039

SCHEMBL27996039

CC(C)C(=O)Oc1ccccc1I

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 2/20 0.46
▸ FABP7 O15540 1/20 0.44
▸ FABP3 P05413 1/20 0.44
▸ FABP5 Q01469 1/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ KMT2A Q03164 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ ADRB2 P07550 1/20 0.40
▸ ADRA2A P08913 1/20 0.40
▸ DRD2 P14416 1/20 0.40
▸ ADRA2C P18825 1/20 0.40
▸ DRD1 P21728 1/20 0.40
▸ ADRA1A P35348 1/20 0.40
▸ DRD3 P35462 1/20 0.40
▸ ALDH1A1 P00352 4/20 0.39
▸ ACHE P22303 1/20 0.39
▸ HTT P42858 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.37

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
SCHEMBL23867037 0.87 FABP7 (0.43) ELANEFABP7FABP3FABP5ALOX15
SCHEMBL15547599 0.86 ALOX15 (0.55) ELANEALOX15KMT2AMEN1ADRB2
SCHEMBL7326080 0.85 FABP7 (0.42) ELANEFABP7FABP3FABP5KMT2A
SCHEMBL15557598 0.84 ALOX15 (0.41) ELANEALOX15KMT2AMEN1ADRB2
Bromide SCHEMBL16050020 0.84 ALOX15 (0.53) ELANEALOX15KMT2AMEN1ADRB2
SCHEMBL27620015 0.82 FABP7 (0.45) ELANEFABP7FABP3FABP5KMT2A
SCHEMBL25519396 0.82 KMT2A (0.43) FABP7FABP3FABP5KMT2AMEN1
SCHEMBL25470000 0.81 FABP7 (0.39) FABP7FABP3FABP5KMT2AALDH1A1
SCHEMBL28540876 0.81 FABP7 (0.44) FABP7FABP3FABP5KMT2AMEN1
SCHEMBL16060611 0.80 ELANE (0.49) ELANEALOX15KMT2AMEN1ADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104263767-A Method for producing iodophenyl methyl propionate through reduction by virtue of candida utilis UNIV QINGDAO SCIENCE & TECHNOLOGY 2015-01-07 — — CN disclosed
CN-104263767-A Method for producing iodophenyl methyl propionate through reduction by virtue of candida utilis UNIV QINGDAO SCIENCE & TECHNOLOGY 2015-01-07 — — CN disclosed
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