SCHEMBL9055207

SCHEMBL9055207

CNC(=O)[C@@H](C(N)=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.51
SRC P12931 1/20 0.50
CTSD P07339 1/20 0.47
POLB P06746 2/20 0.46
MMP8 P22894 1/20 0.45
KMT2A Q03164 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
HDAC9 Q9UKV0 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44
SLC6A3 Q01959 1/20 0.43
ALOX5 P09917 1/20 0.43

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
SCHEMBL6162357 1.00 LMNA (0.51) LMNASRCCTSDPOLBMMP8
SCHEMBL28777621 0.86 SRC (0.64) LMNASRCCTSDPOLBMMP8
SCHEMBL6162055 0.81 KMT2A (0.48) LMNASRCCTSDMMP8KMT2A
SCHEMBL170040 0.80 SRC (0.67) LMNASRCCTSDPOLBSMN1; SMN2
SCHEMBL6575278 0.79 UGT2B7 (0.47) SMN1; SMN2SLC6A3EPHX1
SCHEMBL6573647 0.79 UGT2B7 (0.47) SMN1; SMN2SLC6A3EPHX1
SCHEMBL6342212 0.78 LMNA (0.46) LMNACTSDPOLBKMT2ASMN1; SMN2
SCHEMBL3638914 0.78 LMNA (0.53) LMNACTSDPOLBKMT2AHDAC3
SCHEMBL1515665 0.78 LMNA (0.53) LMNACTSDPOLBKMT2AHDAC3
SCHEMBL3743441 0.78 LMNA (0.53) LMNACTSDPOLBKMT2AHDAC3

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-1996039384-A1 SUBSTITUTED N-(INDOLE-2-CARBONYL)-GLYCINAMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER, INC. (US) 1996-12-12 WO disclosed