SCHEMBL11325306

SCHEMBL11325306

COc1cc([N+](=O)[O-])c[nH]c1=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.56
GLA P06280 1/20 0.56
HTT P42858 2/20 0.50
TDP1 Q9NUW8 4/20 0.45
ERN1 O75460 1/20 0.44
KDM4E B2RXH2 4/20 0.43
PKM P14618 1/20 0.42
PTGS2 P35354 2/20 0.41
CYP19A1 P11511 1/20 0.41
MAPT P10636 2/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
BLM P54132 1/20 0.40
TUBB4A P04350 1/20 0.39
TUBB P07437 1/20 0.39
TUBA3C P0DPH7 1/20 0.39
TUBA1B P68363 1/20 0.39
TUBA4A P68366 1/20 0.39
TUBB4B P68371 1/20 0.39
TUBB3 Q13509 1/20 0.39

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
SCHEMBL2070952 0.76 ALDH1A1 (0.61) ALDH1A1GLATDP1KDM4ECYP19A1
SCHEMBL25367547 0.74 HTT (0.46) ALDH1A1HTTTDP1ERN1KDM4E
SCHEMBL30573358 0.74 HTT (0.46) ALDH1A1HTTTDP1ERN1KDM4E
SCHEMBL3348546 0.73 ALDH1A1 (0.50) ALDH1A1GLAHTTTDP1KDM4E
SCHEMBL3293088 0.73 ALDH1A1 (0.63) ALDH1A1GLATDP1KDM4EMAPT
SCHEMBL11645181 0.72 ALDH1A1 (0.61) ALDH1A1GLAHTTTDP1KDM4E
SCHEMBL28282461 0.72 ALDH1A1 (1.00) ALDH1A1GLATDP1KDM4ECYP19A1
SCHEMBL10651010 0.72 ALDH1A1 (0.61) ALDH1A1GLATDP1KDM4ECYP19A1
SCHEMBL28651135 0.72 ALDH1A1 (0.61) ALDH1A1GLATDP1KDM4ECYP19A1
SCHEMBL28302547 0.71 ALDH1A1 (0.56) ALDH1A1GLAKDM4ECYP19A1MAPT

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-4273706-A Nondiffusible heterocyclylazonaphthol dye-releasing compounds EASTMAN KODAK COMPANY (US) 1981-06-16 US disclosed
US-4207104-A DIFFUSION TRANSFER TO FORM METALLIZED DYE IMAGE OF EXCELLENT STABILITY EASTMAN KODAK COMPANY (US) 1980-06-10 US disclosed
US-4204870-A METALLIZED DYES EASTMAN KODAK COMPANY (US) 1980-05-27 US disclosed