SCHEMBL10833686

SCHEMBL10833686

NC(=NO)c1ccccc1Cl.[NaH]

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.49
L3MBTL1 Q9Y468 4/20 0.48
GAA P10253 3/20 0.48
LMNA P02545 2/20 0.48
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
HTT P42858 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
RAB9A P51151 4/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
HPGD P15428 3/20 0.46
NPC1 O15118 2/20 0.46
PKM P14618 1/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
GFER P55789 1/20 0.45
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.44
POLB P06746 3/20 0.44

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
SCHEMBL101069 0.98 L3MBTL1 (0.50) GRIN2BL3MBTL1GAALMNACES2
SCHEMBL101068 0.98 L3MBTL1 (0.50) GRIN2BL3MBTL1GAALMNACES2
SCHEMBL102709 0.81 TSHR (0.50) GRIN2BL3MBTL1GAALMNARAB9A
SCHEMBL17737959 0.81 TSHR (0.50) GRIN2BL3MBTL1GAALMNARAB9A
SCHEMBL102710 0.81 TSHR (0.50) GRIN2BL3MBTL1GAALMNARAB9A
SCHEMBL101736 0.78 ALDH1A1 (0.45) GRIN2BL3MBTL1GAALMNARAB9A
SCHEMBL17738057 0.78 ALDH1A1 (0.45) GRIN2BL3MBTL1GAALMNARAB9A
SCHEMBL17730397 0.78 GAA (0.41) GRIN2BL3MBTL1GAALMNACES2
SCHEMBL17738056 0.78 GAA (0.41) GRIN2BL3MBTL1GAALMNACES2
SCHEMBL101735 0.78 ALDH1A1 (0.45) GRIN2BL3MBTL1GAALMNARAB9A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0192762-A1 PESTICIDAL TIN AMIDOXIMES CHEVRON RESEARCH COMPANY (US) 1986-09-03 EP disclosed
US-4584317-A FUNGICIDES, MITICIDES CHEVRON RESEARCH COMPANY (US) 1986-04-22 US disclosed
WO-1986001800-A1 PESTICIDAL TIN AMIDOXIMES CHEVRON RESEARCH COMPANY (US) 1986-03-27 WO disclosed