SCHEMBL9853798

SCHEMBL9853798

COC(=O)c1cc(Cl)ccc1Oc1cnccc1[N+](=O)[O-]

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.54
POLB P06746 4/20 0.44
MAPT P10636 2/20 0.43
MAPK1 P28482 1/20 0.43
KCNMA1 Q12791 1/20 0.43
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
RAB9A P51151 1/20 0.42
HTT P42858 1/20 0.42
G6PD P11413 1/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
TGFBR1 P36897 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
KMT2A Q03164 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
SCHEMBL26306447 0.83 TDP1 (0.58) TDP1POLBMAPTMAPK1LMNA
SCHEMBL9853809 0.83 KMT2A (0.50) TDP1POLBMAPTLMNASMN1; SMN2
SCHEMBL31098230 0.83 TDP1 (0.58) TDP1POLBMAPTMAPK1LMNA
SCHEMBL27002380 0.79 MAPT (0.47) TDP1POLBMAPTMAPK1LMNA
SCHEMBL31098218 0.79 TDP1 (0.56) TDP1POLBMAPTLMNASMN1; SMN2
SCHEMBL4637188 0.76 TDP1 (0.58) TDP1POLBMAPTKCNMA1LMNA
SCHEMBL1367920 0.76 TDP1 (0.58) TDP1POLBMAPTKCNMA1LMNA
SCHEMBL31549875 0.76 TDP1 (0.70) TDP1MAPTMAPK1SMN1; SMN2L3MBTL1
SCHEMBL40265 0.76 TDP1 (0.70) TDP1MAPTMAPK1SMN1; SMN2L3MBTL1
SCHEMBL5373256 0.75 PABPC1 (0.57) TDP1POLBMAPTMAPK1KCNMA1

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