SCHEMBL7239605

SCHEMBL7239605

NN=Cc1ccc(OCc2ccccc2)c2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.48
PLAT P00750 1/20 0.48
RAB9A P51151 6/20 0.48
NPC1 O15118 5/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
MAPT P10636 3/20 0.48
L3MBTL1 Q9Y468 3/20 0.48
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
CCR5 P51681 2/20 0.43
ALDH1A1 P00352 3/20 0.43
POLB P06746 3/20 0.43
KMT2A Q03164 2/20 0.43
GAA P10253 1/20 0.43
UBE2N P61088 1/20 0.43
NPSR1 Q6W5P4 2/20 0.41
MEN1 O00255 1/20 0.41
XBP1 P17861 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL7235370 0.89 CCR5 (0.44) PLAUPLATRAB9ANPC1SMN1; SMN2
SCHEMBL2650838 0.85 HTR1A (0.46) PLAUPLATMAPTALDH1A1POLB
SCHEMBL7237910 0.83 ABCB1 (0.49) SMN1; SMN2MAPTHTTMRGPRX4
SCHEMBL2649711 0.83 GCGR (0.56) PLAUPLATRAB9ANPC1SMN1; SMN2
SCHEMBL7235286 0.82 TACR1 (0.42) MAPTL3MBTL1ALDH1A1POLBGAA
SCHEMBL16230494 0.81 ALDH1A1 (0.61) RAB9ANPC1SMN1; SMN2MAPTL3MBTL1
SCHEMBL7227813 0.80 GCGR (0.47) PLAUPLATGCGRMRGPRX4MAPK14
SCHEMBL7228342 0.80 ALDH1A1 (0.37) PLAUPLATRAB9ANPC1SMN1; SMN2
SCHEMBL7235343 0.80 ALDH1A1 (0.52) RAB9ANPC1SMN1; SMN2MAPTL3MBTL1
SCHEMBL416462 0.80 MAPT (0.57) PLAUPLATRAB9ANPC1SMN1; 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
US-6613942-B1 Nonpeptide; 4-hydroxy benzoic acid hydrazides NOVO NORDISK A/S (DK) 2003-09-02 US disclosed