SCHEMBL9313845

SCHEMBL9313845

Cc1cc(OCc2ccccc2)c([N+](=O)[O-])cc1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSV O60911 4/20 0.50
CTSL P07711 4/20 0.50
POLB P06746 1/20 0.48
MAPT P10636 3/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
CYP19A1 P11511 2/20 0.47
ABCB1 P08183 1/20 0.47
CDK1 P06493 1/20 0.45
CCNB1 P14635 1/20 0.45
GSK3B P49841 1/20 0.45
CDK5 Q00535 1/20 0.45
CDK5R1 Q15078 1/20 0.45
MYC P01106 1/20 0.44
MAX P61244 1/20 0.44
FFAR4 Q5NUL3 1/20 0.44
HTR1A P08908 1/20 0.44
ADRA1D P25100 1/20 0.44
ADRA1A P35348 1/20 0.44
ADRA1B P35368 1/20 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
SCHEMBL9005400 0.85 CTSV (0.53) CTSVCTSLPOLBMAPTMEN1
SCHEMBL2722340 0.84 CTSV (0.60) CTSVCTSLPOLBMAPTMEN1
SCHEMBL4647237 0.84 POLB (0.48) CTSVCTSLPOLBMAPTMEN1
SCHEMBL8009518 0.83 MAPT (0.52) CTSVCTSLPOLBMAPTMEN1
SCHEMBL7116860 0.82 POLB (0.56) CTSVCTSLPOLBMAPTMEN1
SCHEMBL14484687 0.82 MAPT (0.51) CTSVCTSLPOLBMAPTMEN1
SCHEMBL2722311 0.81 CTSV (0.54) CTSVCTSLMAPTMEN1KMT2A
SCHEMBL1040246 0.80 CTSV (0.51) CTSVCTSLPOLBMAPTMEN1
SCHEMBL4644957 0.80 CTSV (0.60) CTSVCTSLPOLBMAPTMEN1
SCHEMBL30184780 0.80 CTSV (0.51) CTSVCTSLPOLBMAPTMEN1

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-5334225-A Imparts color tone of high chroma; excellent in coloring power and fastness KAO CORPORATION (JP) 1994-08-02 US disclosed
EP-0579204-A2 Dye composition for a keratinous fiber KAO CORPORATION (JP) 1994-01-19 EP disclosed
US-4055428-A COLO PHOTOGRAPHY, DIFFUSION TRANSFER SILVER HALIDE EMULSIONS FUJI PHOTO FILM CO., LTD. (JA) 1977-10-25 US disclosed