SCHEMBL7531320

SCHEMBL7531320

COc1ccccc1/N=N/c1ccccc1CO[C]=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
MAPT P10636 4/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
IDO1 P14902 2/20 0.40
ALDH1A1 P00352 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 1/20 0.39
LMNA P02545 2/20 0.38
HTT P42858 2/20 0.38
MAPK1 P28482 1/20 0.38
OPRK1 P41145 1/20 0.38
MMP14 P50281 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
GPR55 Q9Y2T6 1/20 0.38
NSD2 O96028 1/20 0.37
HSP90AA1 P07900 1/20 0.37
CASP6 P55212 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37

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
SCHEMBL65021 0.82 IDO1 (0.58) MAPTL3MBTL1IDO1ALDH1A1HTT
SCHEMBL6549408 0.81 MEN1 (0.43) KMT2AMEN1MAPTL3MBTL1ALDH1A1
SCHEMBL2920835 0.80 ALDH1A1 (0.40) KMT2AMEN1MAPTL3MBTL1ALDH1A1
SCHEMBL164746 0.77 SMN1; SMN2 (0.46) KMT2AMEN1MAPTL3MBTL1IDO1
SCHEMBL1405475 0.76 CA1 (0.60) KMT2AMEN1MAPTL3MBTL1ALDH1A1
SCHEMBL1405477 0.76 CA1 (0.60) KMT2AMEN1MAPTL3MBTL1ALDH1A1
SCHEMBL1807876 0.74 ABCB1 (0.50) KMT2AMEN1L3MBTL1ALDH1A1LMNA
SCHEMBL16287599 0.70 SLC6A3 (0.32)
SCHEMBL2096467 0.70 CA1 (0.41) MAPTIDO1ALDH1A1LMNAMAPK1
SCHEMBL1054893 0.69 L3MBTL1 (0.56) KMT2AMEN1MAPTL3MBTL1ALDH1A1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1198472-A1 AMINE-MODIFIED PSEUDOMYCIN COMPOUNDS ELI LILLY AND COMPANY (US) 2002-04-24 EP disclosed
WO-2001005816-A1 AMINE-MODIFIED PSEUDOMYCIN COMPOUNDS ELI LILLY AND COMPANY (US) 2001-01-25 WO disclosed
EP-0389437-A1 Luciferin derivatives NIPPON ZOKI PHARMACEUTICAL CO. LTD. (JP) 1990-09-26 EP disclosed
EP-0043247-B1 PEPTIDES FOR USE IN DETERMINING SERUM THYMIC FACTOR KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1984-02-01 EP disclosed
US-4404133-A TYROSINE DERIVATIVES, SERUM THYMIC FACTOR ANALOGS KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1983-09-13 US disclosed
EP-0043247-A1 Peptides for use in determining serum thymic factor KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1982-01-06 EP disclosed