SCHEMBL10600910

SCHEMBL10600910

O=[N+]([O-])c1cc(NCC(O)CO)c(O)c([N+](=O)[O-])c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.48
GPR35 Q9HC97 6/20 0.47
KMT2A Q03164 4/20 0.47
ALDH1A1 P00352 3/20 0.47
MAPT P10636 3/20 0.47
MAPK1 P28482 3/20 0.47
MEN1 O00255 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
HPGD P15428 2/20 0.47
KDM4E B2RXH2 1/20 0.47
TTR P02766 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
ALOX15 P16050 1/20 0.47
ALOX12 P18054 1/20 0.47
RECQL P46063 1/20 0.47
PMP22 Q01453 1/20 0.47
HIF1A Q16665 1/20 0.47
HSD17B10 Q99714 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL23789 0.80 ALDH1A1 (0.53) GPR35KMT2AALDH1A1MAPTMAPK1
SCHEMBL453875 0.78 GPR35 (0.56) GPR35KMT2AALDH1A1MAPTMAPK1
SCHEMBL10601066 0.77 ALDH1A1 (0.51) GPR35KMT2AALDH1A1MAPTMAPK1
SCHEMBL27887955 0.76 GLA (0.51) GLAKMT2AALDH1A1MAPTMAPK1
SCHEMBL10896768 0.76 MAPT (0.45) GLAKMT2AALDH1A1MAPTMEN1
SCHEMBL9650193 0.76 GLA (0.49) GLAGPR35KMT2AALDH1A1MAPT
SCHEMBL10442762 0.75 MEN1 (0.52) GLAKMT2AALDH1A1MAPTMEN1
SCHEMBL10892179 0.74 MAPT (0.46) GLAGPR35KMT2AALDH1A1MAPT
SCHEMBL10892536 0.74 MAPT (0.46) GLAALDH1A1MAPTTDP1CYP1A2
SCHEMBL4614055 0.74 GPR35 (0.54) GPR35KMT2AALDH1A1MAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0151400-B1 HAIR DYEING COMPOSITIONS WITH PICRAMIC ACID DERIVATIVES, NEW PICRAMIC ACID DERIVATIVES AND PROCESS FOR PREPARING SAME Wella Aktiengesellschaft (DE) 1989-05-24 EP claimed
EP-0151400-A2 Hair dyeing compositions with picramic acid derivatives, new picramic acid derivatives and process for preparing same Wella Aktiengesellschaft (DE) 1985-08-14 EP claimed
WO-1985003222-A1 HAIR COLORANT WITH PICRAMIC ACID DERIVATIVES, NEW PICRAMIC ACID DERIVATIVES AND PRODUCTION PROCESS THEREOF WELLA AKTIENGESELLSCHAFT (DE) 1985-08-01 WO claimed
EP-0151400-B1 HAIR DYEING COMPOSITIONS WITH PICRAMIC ACID DERIVATIVES, NEW PICRAMIC ACID DERIVATIVES AND PROCESS FOR PREPARING SAME Wella Aktiengesellschaft (DE) 1989-05-24 EP disclosed
EP-0151400-A2 Hair dyeing compositions with picramic acid derivatives, new picramic acid derivatives and process for preparing same Wella Aktiengesellschaft (DE) 1985-08-14 EP disclosed
WO-1985003222-A1 HAIR COLORANT WITH PICRAMIC ACID DERIVATIVES, NEW PICRAMIC ACID DERIVATIVES AND PRODUCTION PROCESS THEREOF WELLA AKTIENGESELLSCHAFT (DE) 1985-08-01 WO disclosed