SCHEMBL9853813

SCHEMBL9853813

CC(=O)c1ccccc1Oc1cnccc1[N+](=O)[O-]

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.49
L3MBTL1 Q9Y468 3/20 0.49
MEN1 O00255 1/20 0.49
POLB P06746 1/20 0.49
MAPT P10636 4/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
HTT P42858 4/20 0.45
GAA P10253 1/20 0.45
NCOA1 Q15788 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NCOA3 Q9Y6Q9 1/20 0.45
ALDH1A1 P00352 4/20 0.45
RAB9A P51151 1/20 0.43
TDP1 Q9NUW8 2/20 0.42
HPGD P15428 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ESR2 Q92731 1/20 0.40

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
SCHEMBL9853809 0.87 KMT2A (0.50) KMT2AL3MBTL1MEN1POLBMAPT
SCHEMBL5739618 0.84 L3MBTL1 (0.61) KMT2AL3MBTL1MEN1POLBMAPT
SCHEMBL8560647 0.78 HTT (0.50) KMT2AL3MBTL1MAPTCYP1A2CYP2C9
SCHEMBL9853829 0.77 LMNA (0.45) KMT2AL3MBTL1MEN1POLBMAPT
SCHEMBL2013294 0.76 KMT2A (0.55) KMT2AL3MBTL1MEN1POLBMAPT
SCHEMBL27972730 0.76 MAPT (0.49) KMT2AL3MBTL1MEN1POLBMAPT
SCHEMBL9853818 0.76 MAPT (0.47) KMT2AL3MBTL1MAPTCYP1A2CYP2C9
SCHEMBL5708950 0.74 LMNA (0.60) KMT2AL3MBTL1MEN1POLBMAPT
SCHEMBL12672297 0.74 HTT (0.45) KMT2AL3MBTL1MEN1POLBMAPT
SCHEMBL9853798 0.73 TDP1 (0.54) KMT2AL3MBTL1POLBMAPTHTT

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-4959377-A Phenoxypyridinamine compounds which are use as a dermatological composition HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1990-09-25 US claimed
EP-0405487-A1 Phenoxypyridinamines and related compounds, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1991-01-02 EP disclosed
US-4959377-A Phenoxypyridinamine compounds which are use as a dermatological composition HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1990-09-25 US disclosed