SCHEMBL16601760

SCHEMBL16601760

CCC(CO)N=C1c2cc([N+](=O)[O-])cc(-c3ccc(O)cc3)c2-c2c1cc([N+](=O)[O-])cc2[N+](=O)[O-]

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HSP90AA1 P07900 1/20 0.36
HKDC1 Q2TB90 1/20 0.35
AKR1C3 P42330 1/20 0.34
AKR1C2 P52895 1/20 0.34
ALDH1A1 P00352 4/20 0.33
GPR35 Q9HC97 3/20 0.33
HPRT1 P00492 1/20 0.33
MAPT P10636 4/20 0.32
MAPK1 P28482 3/20 0.32
GAA P10253 3/20 0.32
RECQL P46063 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
ELANE P08246 1/20 0.32
LMNA P02545 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
BACE1 P56817 2/20 0.32
HPGD P15428 2/20 0.32
TP53 P04637 1/20 0.32

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
SCHEMBL16601750 0.84 HSP90AA1 (0.53) MEN1KMT2AHSP90AA1HKDC1ALDH1A1
SCHEMBL16601759 0.75 HSP90AA1 (0.43) MEN1KMT2AHSP90AA1HKDC1ALDH1A1
SCHEMBL16656172 0.71 HSP90AA1 (0.47) MEN1KMT2AHSP90AA1HKDC1ALDH1A1
SCHEMBL27815805 0.70 GPR35 (0.52) MEN1KMT2AHSP90AA1ALDH1A1GPR35
SCHEMBL27374917 0.70 TDP1 (0.51) MEN1KMT2AHSP90AA1ALDH1A1GPR35
SCHEMBL16601751 0.70 HSP90AA1 (0.47) MEN1KMT2AHSP90AA1HKDC1ALDH1A1
SCHEMBL28300093 0.67 GPR35 (0.58) MEN1KMT2AALDH1A1GPR35MAPT
SCHEMBL14389444 0.66 HSP90AA1 (0.53) MEN1KMT2AHSP90AA1HKDC1ALDH1A1
SCHEMBL4667166 0.65 ALDH1A1 (0.58) MEN1KMT2AALDH1A1GPR35MAPT
SCHEMBL28272052 0.65 GPR35 (0.58) MEN1KMT2AALDH1A1GPR35MAPT

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
US-9012112-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-04-21 US disclosed
US-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed
US-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed