SCHEMBL9853587

SCHEMBL9853587

O=[N+]([O-])c1cc[n+]([O-])cc1Oc1ccc2cc(Br)ccc2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.37
MAPT P10636 4/20 0.37
LMNA P02545 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
GAA P10253 3/20 0.36
HTT P42858 2/20 0.36
KDM4E B2RXH2 2/20 0.36
GLA P06280 1/20 0.36
HPGD P15428 1/20 0.36
PIN1 Q13526 1/20 0.35
HSPB1 P04792 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TBXA2R P21731 2/20 0.34
PTPN1 P18031 1/20 0.33
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PDE7A Q13946 1/20 0.33
NCEH1 Q6PIU2 1/20 0.33

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
SCHEMBL4376514 0.88 LMNA (0.42) ALDH1A1MAPTLMNASMN1; SMN2TDP1
SCHEMBL9853579 0.87 PIN1 (0.47) ALDH1A1MAPTLMNASMN1; SMN2TDP1
SCHEMBL7055435 0.77 ALDH1A1 (0.45) ALDH1A1MAPTLMNASMN1; SMN2TDP1
SCHEMBL9853789 0.77 MERTK (0.48) ALDH1A1MAPTLMNASMN1; SMN2TDP1
SCHEMBL4375480 0.77 PDE7A (0.49) ALDH1A1MAPTLMNASMN1; SMN2TDP1
SCHEMBL4377981 0.76 MEN1 (0.48) ALDH1A1MAPTLMNASMN1; SMN2TDP1
SCHEMBL9853578 0.76 SMN1; SMN2 (0.41) ALDH1A1MAPTLMNASMN1; SMN2HTT
SCHEMBL4383031 0.76 EPAS1 (0.44) ALDH1A1MAPTTDP1HPGDHSPB1
SCHEMBL4381239 0.75 MEN1 (0.51) ALDH1A1MAPTLMNASMN1; SMN2TDP1
SCHEMBL2370724 0.74 TDP1 (0.40) ALDH1A1MAPTSMN1; SMN2TDP1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0405426-A2 Naphthylamino- and naphthyloxy-pyridinamines and related compounds, a process for their preparation and their use as dermatological agents HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1991-01-02 EP claimed
US-4931457-A Naphthylamino-and naphthyloxy-pyridinamine comounds useful as topical antiinflammatory agents for the treatment of skin disorders HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1990-06-05 US claimed
EP-0405426-A2 Naphthylamino- and naphthyloxy-pyridinamines and related compounds, a process for their preparation and their use as dermatological agents HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1991-01-02 EP disclosed
US-4931457-A Naphthylamino-and naphthyloxy-pyridinamine comounds useful as topical antiinflammatory agents for the treatment of skin disorders HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1990-06-05 US disclosed