SCHEMBL27817512

SCHEMBL27817512

CC(O)NC(=O)c1ccc(C(=O)NC(C)O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.52
MLYCD O95822 2/20 0.52
SMN1; SMN2 Q16637 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
ALDH1A1 P00352 4/20 0.47
HTT P42858 3/20 0.47
LMNA P02545 2/20 0.47
CYP1A2 P05177 1/20 0.47
ALOX15 P16050 1/20 0.47
CYP2C19 P33261 1/20 0.47
PTGS2 P35354 1/20 0.47
RAB9A P51151 1/20 0.47
NPC1 O15118 1/20 0.47
CA2 P00918 4/20 0.46
CA1 P00915 2/20 0.46
HDAC1 Q13547 2/20 0.46
HDAC8 Q9BY41 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
TSHR P16473 1/20 0.45

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
SCHEMBL12093587 0.91 HPGD (0.65) HPGDMLYCDSMN1; SMN2MEN1KMT2A
SCHEMBL9425774 0.91 GFER (0.52) HPGDMLYCDSMN1; SMN2MEN1KMT2A
SCHEMBL12089430 0.89 RAB9A (0.50) HPGDSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL8587216 0.89 NPC1 (0.57) HPGDMLYCDSMN1; SMN2MEN1KMT2A
SCHEMBL6834922 0.89 ALDH1A1 (0.56) HPGDSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL6835136 0.86 CA1 (0.61) SMN1; SMN2MEN1KMT2AALDH1A1CYP1A2
SCHEMBL18579396 0.86 ALDH1A1 (0.62) HPGDKMT2AALDH1A1HTTLMNA
SCHEMBL17313750 0.84 MEN1 (0.45) HPGDMLYCDSMN1; SMN2MEN1KMT2A
SCHEMBL8982349 0.84 ALDH1A1 (0.49) HPGDSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL11163745 0.83 RAB9A (0.61) HPGDSMN1; SMN2MEN1KMT2AALDH1A1

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-102161626-A Diamide compound with two acrylates and preparation method and application thereof UNIV HEFEI TECHNOLOGY 2011-08-24 CN disclosed