SCHEMBL7455809

SCHEMBL7455809

CNC1(NC)C=CC(/N=N/c2ccccc2)C=C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
MAPT P10636 7/20 0.35
RAB9A P51151 5/20 0.35
NPC1 O15118 4/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
TDP1 Q9NUW8 3/20 0.35
MAPK1 P28482 3/20 0.35
LMNA P02545 2/20 0.35
TSHR P16473 2/20 0.33
CYP1A1 P04798 1/20 0.33
CYP1B1 Q16678 1/20 0.33
HSD17B10 Q99714 1/20 0.32
MEN1 O00255 4/20 0.32
KMT2A Q03164 4/20 0.32
CASP3 P42574 2/20 0.32
SENP7 Q9BQF6 2/20 0.32
SENP6 Q9GZR1 2/20 0.32
GAA P10253 1/20 0.32
SENP8 Q96LD8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL28922658 0.81 ALDH1A1 (0.41) ALDH1A1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL10385045 0.79 ALDH1A1 (0.38) ALDH1A1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL5805988 0.78 ALDH1A1 (0.41) ALDH1A1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL29107376 0.78 ALDH1A1 (0.41) ALDH1A1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL10440152 0.78 ALDH1A1 (0.41) ALDH1A1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL23246402 0.78 ALDH1A1 (0.41) ALDH1A1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL11316368 0.77 ALDH1A1 (0.34) ALDH1A1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL8618511 0.76 ALDH1A1 (0.38) ALDH1A1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL11120593 0.76 ALDH1A1 (0.38) ALDH1A1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL8642633 0.76 MAPK1 (0.38) ALDH1A1MAPTRAB9ANPC1SMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1060377-A4 REAGENTS AND METHODS FOR PROTEIN MICROSEQUENCING BIOTRACES INC (US) 2002-06-12 EP disclosed
EP-1060377-A2 REAGENTS AND METHODS FOR PROTEIN MICROSEQUENCING Biotraces Inc. (US) 2000-12-20 EP disclosed
WO-1999049292-A9 REAGENTS AND METHODS FOR PROTEIN MICROSEQUENCING BIOTRACES INC (US) 1999-12-09 WO disclosed
WO-1999049292-A2 REAGENTS AND METHODS FOR PROTEIN MICROSEQUENCING BIOTRACES, INC. (US) 1999-09-30 WO disclosed