SCHEMBL11134142

SCHEMBL11134142

NC(=O)C(=NOc1ccccc1)c1ccco1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.51
PKM P14618 5/20 0.51
LMNA P02545 2/20 0.47
TP53 P04637 1/20 0.47
PTGS1 P23219 1/20 0.46
RAB9A P51151 6/20 0.45
NPC1 O15118 5/20 0.45
MAPT P10636 2/20 0.45
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
KMT2A Q03164 5/20 0.44
ALDH1A1 P00352 5/20 0.43
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.43
GFER P55789 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
POLB P06746 2/20 0.43
HPGD P15428 1/20 0.43
PTPN1 P18031 1/20 0.42

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
SCHEMBL11535484 0.88 SMN1; SMN2 (0.49) SMN1; SMN2PKMLMNATP53RAB9A
SCHEMBL11134139 0.85 SMN1; SMN2 (0.47) SMN1; SMN2PKMLMNATP53RAB9A
SCHEMBL11134141 0.85 SMN1; SMN2 (0.47) SMN1; SMN2PKMLMNATP53RAB9A
SCHEMBL12180935 0.80 CES2 (0.50) SMN1; SMN2PKMLMNAPTGS1RAB9A
SCHEMBL9706848 0.80 CES2 (0.50) SMN1; SMN2PKMLMNAPTGS1RAB9A
SCHEMBL11329136 0.77 SMN1; SMN2 (0.44) SMN1; SMN2PKMLMNATP53RAB9A
SCHEMBL11329134 0.77 SMN1; SMN2 (0.44) SMN1; SMN2PKMLMNATP53RAB9A
SCHEMBL11135486 0.76 KMT2A (0.46) SMN1; SMN2PKMLMNATP53PTGS1
SCHEMBL11133433 0.76 KMT2A (0.46) SMN1; SMN2PKMLMNAPTGS1RAB9A
SCHEMBL11520447 0.75 CES2 (0.52) SMN1; SMN2PKMLMNAPTGS1RAB9A

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
US-4399277-A 7-Amino-3-phosphonocephalosporanic acid compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-08-16 US disclosed