SCHEMBL11366159

SCHEMBL11366159

Cc1cc(-n2c(=O)n3n(c2=O)CCCC3)ccc1Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.54
CTSB P07858 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
MAPT P10636 1/20 0.40
GFER P55789 1/20 0.40
CCR1 P32246 1/20 0.40
CCR2 P41597 1/20 0.40
KMT2A Q03164 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 1/20 0.39
MEN1 O00255 1/20 0.39
PKM P14618 1/20 0.39
POLB P06746 1/20 0.39
USP2 O75604 1/20 0.38
HSD17B10 Q99714 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MYC P01106 1/20 0.37
NR4A1 P22736 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
SCHEMBL11363847 0.90 ALDH1A1 (0.44) ALDH1A1CTSBTDP1NPC1RAB9A
SCHEMBL11376839 0.86 ALDH1A1 (0.53) ALDH1A1MAPTGFERKMT2ASMN1; SMN2
SCHEMBL11367120 0.84 ALDH1A1 (0.59) ALDH1A1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL11371084 0.83 ALDH1A1 (0.57) ALDH1A1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL11376353 0.82 NPC1 (0.37) ALDH1A1CTSBTDP1NPC1RAB9A
SCHEMBL11359619 0.82 ALDH1A1 (0.49) ALDH1A1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL11368471 0.81 ALDH1A1 (0.64) ALDH1A1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL11413626 0.79 ALDH1A1 (0.49) ALDH1A1TDP1MAPTGFERKMT2A
SCHEMBL16727172 0.77 MAPT (0.53) ALDH1A1TDP1NPC1RAB9AMAPT
SCHEMBL11365234 0.77 ALDH1A1 (0.49) ALDH1A1NPC1RAB9AMAPTKMT2A

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-4249934-A 1,2-Alkylene-4-substituted urazole herbicides MITSUBISHI CHEMICAL INDUSTRIES, LIMITED (JP) 1981-02-10 US disclosed