SCHEMBL27100786

SCHEMBL27100786

CC1(C)c2cc(C(=O)c3ccccc3)ccc2NC12C=Cc1cccc([N+](=O)[O-])c1O2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.39
VCAM1 P19320 1/20 0.39
TDP2 O95551 2/20 0.35
ALDH1A1 P00352 4/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
GFER P55789 1/20 0.33
MAPT P10636 3/20 0.33
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
POLB P06746 1/20 0.32
LMNA P02545 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALOX5 P09917 1/20 0.32
CDC25B P30305 1/20 0.31
HTT P42858 1/20 0.31
ABCC3 O15438 1/20 0.31
ABCC4 O15439 1/20 0.31
NR1I2 O75469 1/20 0.31
ABCB11 O95342 1/20 0.31

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
SCHEMBL27100805 0.87 ALDH1A1 (0.38) MAPK1VCAM1ALDH1A1MEN1KMT2A
SCHEMBL27100814 0.83 MAPK1 (0.34) MAPK1VCAM1ALDH1A1MEN1KMT2A
SCHEMBL27100754 0.83 MEN1 (0.41) MAPK1VCAM1TDP2ALDH1A1MEN1
SCHEMBL27100749 0.83 MEN1 (0.47) MAPK1VCAM1TDP2ALDH1A1MEN1
SCHEMBL27100813 0.82 ALDH1A1 (0.36) MAPK1VCAM1ALDH1A1MEN1KMT2A
SCHEMBL27100747 0.81 ALDH1A1 (0.34) MAPK1ALDH1A1MAPTPOLBLMNA
SCHEMBL27100756 0.81 MEN1 (0.51) MAPK1VCAM1TDP2ALDH1A1MEN1
SCHEMBL27100793 0.80 ALOX5 (0.32) MAPK1ALDH1A1MEN1KMT2AMAPT
SCHEMBL27100757 0.80 MEN1 (0.37) ALDH1A1MEN1KMT2AGFERMAPT
SCHEMBL27100795 0.79 ALOX5 (0.32) MAPK1ALDH1A1MEN1KMT2AMAPT

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-20240066790-A1 Process and apparatus for locally polymerizing a starting material by dual color photopolymerization and method for volumetric printing of a shaped body XOLO GMBH (DE) 2024-02-29 US disclosed