SCHEMBL9711477

SCHEMBL9711477

O=C1CCNC(=O)C1C(=O)c1cc(Cl)c(Cl)cc1[N+](=O)[O-]

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPD P32754 1/20 0.42
MEN1 O00255 1/20 0.34
PKM P14618 1/20 0.34
KMT2A Q03164 1/20 0.34
CA12 O43570 1/20 0.33
CA9 Q16790 1/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.33
VCAM1 P19320 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.31
LMNA P02545 1/20 0.31
GPR35 Q9HC97 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
SCHEMBL9711723 0.91 HPD (0.40) HPDMEN1PKMKMT2ACA12
SCHEMBL9711516 0.85 HPD (0.48) HPDMEN1PKMKMT2AALDH1A1
SCHEMBL9711464 0.85 KMT2A (0.50) HPDMEN1PKMKMT2AALDH1A1
SCHEMBL9711637 0.82 LMNA (0.32) MEN1KMT2ALMNA
SCHEMBL9711712 0.80 SMN1; SMN2 (0.44) MEN1PKMKMT2AALDH1A1MAPT
SCHEMBL9711711 0.80 HPD (0.48) HPDPKMCA12CA9ALDH1A1
SCHEMBL9711681 0.80 TSHR (0.41) HPDMEN1PKMKMT2AALDH1A1
SCHEMBL9711660 0.80 HPD (0.51) HPDALDH1A1MAPT
SCHEMBL9711486 0.79 ALDH1A1 (0.44) HPDMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL9711602 0.78 HPD (0.46) HPDMEN1PKMKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5114461-A Herbicides MAY & BAKER LIMITED (GB) 1992-05-19 US disclosed
EP-0278742-A2 Cyclic diones MAY & BAKER LIMITED (GB) 1988-08-17 EP disclosed