SCHEMBL9005885

SCHEMBL9005885

NCCCC[C@H](NO)C(=O)OCC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.45
GSR P00390 1/20 0.40
RNPEP Q9H4A4 1/20 0.39
CYP2D6 P10635 1/20 0.36
NFKB1 P19838 1/20 0.36
CPB2 Q96IY4 3/20 0.36
BLM P54132 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
PLG P00747 1/20 0.35
LMNA P02545 1/20 0.35
THRB P10828 1/20 0.35
ALOX15 P16050 1/20 0.35
SLC6A2 P23975 1/20 0.35
RECQL P46063 1/20 0.35
SLC6A3 Q01959 1/20 0.35
KMT2A Q03164 1/20 0.35
MMP2 P08253 1/20 0.35
MMP9 P14780 1/20 0.35

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
SCHEMBL5271108 0.81 CPB2 (0.54) FOLH1GSRCPB2ALDH1A1KMT2A
SCHEMBL5271116 0.81 CPB2 (0.54) FOLH1GSRCPB2ALDH1A1KMT2A
SCHEMBL7224725 0.80 ANPEP (0.44) FOLH1GSRRNPEPCPB2ANPEP
SCHEMBL7224727 0.80 ANPEP (0.44) FOLH1GSRRNPEPCPB2ANPEP
SCHEMBL6151760 0.80 FOLH1 (0.41) FOLH1GSRRNPEPCPB2MMP2
SCHEMBL48406 0.77 FOLH1 (0.58) FOLH1GSRRNPEPCYP2D6NFKB1
SCHEMBL48407 0.77 FOLH1 (0.58) FOLH1GSRRNPEPCYP2D6NFKB1
SCHEMBL1054672 0.77 FOLH1 (0.58) FOLH1GSRRNPEPCYP2D6NFKB1
SCHEMBL154982 0.77 GSR (0.59) FOLH1GSRRNPEPCYP2D6NFKB1
SCHEMBL677964 0.76 SIRT6 (0.39) FOLH1GSRRNPEPCPB2ANPEP

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
EP-0736770-A2 An immunoreactive conjugate, method for its preparation, antibodies to said conjugate and a pharmaceutical composition and diagnostic device containing them ANDA BIOLOGICALS S.A. (FR) 1996-10-09 EP claimed
EP-0736770-A2 An immunoreactive conjugate, method for its preparation, antibodies to said conjugate and a pharmaceutical composition and diagnostic device containing them ANDA BIOLOGICALS S.A. (FR) 1996-10-09 EP disclosed