SCHEMBL7954572

SCHEMBL7954572

CCOC(=O)CCC(NC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)OCC

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
KDM4E B2RXH2 2/20 0.55
HPGD P15428 1/20 0.55
HSD17B10 Q99714 1/20 0.55
LMNA P02545 1/20 0.54
MAPT P10636 5/20 0.52
GAA P10253 1/20 0.52
KMT2A Q03164 2/20 0.50
POLB P06746 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 1/20 0.46
TP53 P04637 1/20 0.46
RAB9A P51151 1/20 0.46
CRHBP P24387 2/20 0.46
CRHR2 Q13324 2/20 0.46

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
SCHEMBL7775216 1.00 ALDH1A1 (0.55) ALDH1A1L3MBTL1KDM4EHPGDHSD17B10
SCHEMBL7954574 1.00 ALDH1A1 (0.55) ALDH1A1L3MBTL1KDM4EHPGDHSD17B10
SCHEMBL27584197 0.89 L3MBTL1 (0.65) ALDH1A1L3MBTL1KDM4EHPGDHSD17B10
SCHEMBL7519384 0.88 LMNA (0.56) ALDH1A1L3MBTL1KDM4ELMNAMAPT
SCHEMBL7519380 0.88 LMNA (0.56) ALDH1A1L3MBTL1KDM4ELMNAMAPT
SCHEMBL10828884 0.86 MAPT (0.54) ALDH1A1L3MBTL1KDM4EHPGDHSD17B10
SCHEMBL8536590 0.86 KMT2A (0.57) ALDH1A1L3MBTL1KDM4EHPGDHSD17B10
SCHEMBL10828876 0.86 MAPT (0.54) ALDH1A1L3MBTL1KDM4EHPGDHSD17B10
SCHEMBL16509378 0.85 L3MBTL1 (0.61) ALDH1A1L3MBTL1KDM4EHPGDHSD17B10
SCHEMBL7167160 0.84 L3MBTL1 (0.53) ALDH1A1L3MBTL1KDM4EHPGDHSD17B10

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
US-6306203-B1 FOR USE IN INK JET PRINTING, INCLUDING PIEZOELECTRIC INK JET PRINTING AND ACOUSTIC INK JET PRINTING XEROX CORPORATION 2001-10-23 US claimed
US-6306203-B1 FOR USE IN INK JET PRINTING, INCLUDING PIEZOELECTRIC INK JET PRINTING AND ACOUSTIC INK JET PRINTING XEROX CORPORATION 2001-10-23 US disclosed