SCHEMBL28477283

SCHEMBL28477283

CC(C)(C)OC(=O)CCNc1ccc(Br)cc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 6/20 0.47
FPR3 P25089 4/20 0.47
HPGD P15428 2/20 0.45
POLB P06746 2/20 0.42
KMT2A Q03164 4/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
MEN1 O00255 3/20 0.41
SMN1; SMN2 Q16637 6/20 0.41
RECQL P46063 1/20 0.41
THRB P10828 1/20 0.39
LMNA P02545 2/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL28466017 0.86 MAPT (0.50) POLBKMT2AMEN1SMN1; SMN2LMNA
SCHEMBL28468138 0.84 CA1 (0.47) POLBKMT2ANPC1RAB9AMEN1
SCHEMBL28466046 0.84 MAPT (0.47) FPR2POLBKMT2ANPC1RAB9A
SCHEMBL5930648 0.84 POLB (0.42) FPR2FPR3POLBKMT2ANPC1
SCHEMBL8299387 0.84 FPR2 (0.47) FPR2FPR3HPGDPOLBKMT2A
SCHEMBL5151596 0.84 POLB (0.44) POLBLMNA
SCHEMBL26251369 0.83 HPGD (0.63) FPR2FPR3HPGDPOLBKMT2A
SCHEMBL28471566 0.83 MAPT (0.56) POLBNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL25138047 0.82 GAA (0.46) HPGDKMT2ARAB9AMEN1SMN1; SMN2
SCHEMBL31042792 0.82 GAA (0.46) HPGDKMT2ARAB9AMEN1SMN1; SMN2

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
CN-111676255-A Method for synthesizing 3-phenylaminopropylhydroxamic acid on line under catalysis of lipase 浙江农林大学 2020-09-18 CN disclosed