SCHEMBL27100792

SCHEMBL27100792

CC1(C)c2cc(C(=O)c3ccccc3)ccc2NC12C=Cc1cc(I)ccc1O2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35
AKR1C1 Q04828 1/20 0.35
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
GFER P55789 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
NPSR1 Q6W5P4 3/20 0.32
MAPT P10636 3/20 0.32
GAA P10253 3/20 0.31
TDP1 Q9NUW8 2/20 0.31
LMNA P02545 1/20 0.31
ALPG P10696 1/20 0.31
RECQL P46063 1/20 0.31
TP53 P04637 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ABCC9 O60706 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
SCHEMBL27100757 0.93 MEN1 (0.37) ALDH1A1AKR1C3AKR1C2AKR1C1MEN1
SCHEMBL27100747 0.89 ALDH1A1 (0.34) ALDH1A1AKR1C3AKR1C2AKR1C1NPC1
SCHEMBL27100753 0.88 ALDH1A1 (0.33) ALDH1A1AKR1C3AKR1C2AKR1C1MEN1
SCHEMBL27100761 0.87 MEN1 (0.33) MEN1KMT2AGFERPTGS1COXFA4
SCHEMBL27100763 0.87 MEN1 (0.37) ALDH1A1AKR1C3AKR1C2AKR1C1MEN1
SCHEMBL27100790 0.87 SMN1; SMN2 (0.42) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL27100749 0.86 MEN1 (0.47) ALDH1A1MEN1KMT2AGFERNPC1
SCHEMBL27100795 0.85 ALOX5 (0.32) ALDH1A1AKR1C3AKR1C2AKR1C1MEN1
SCHEMBL27100809 0.85 HPGD (0.36) ALDH1A1AKR1C3AKR1C2AKR1C1NPC1
SCHEMBL27100801 0.84 MAOB (0.37) ALDH1A1AKR1C3AKR1C2AKR1C1MEN1

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