SCHEMBL11815995

SCHEMBL11815995

CC1=CC(=O)C=CC1=NCl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PABPC1 P11940 2/20 0.46
▸ MAPT P10636 3/20 0.37
▸ HTT P42858 1/20 0.37
▸ IDO1 P14902 1/20 0.36
▸ TDO2 P48775 1/20 0.36
▸ NSD2 O96028 1/20 0.36
▸ DNMT1 P26358 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.34
▸ GAA P10253 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ ERBB2 P04626 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ RECQL P46063 2/20 0.32
▸ TDP1 Q9NUW8 2/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ HPGD P15428 1/20 0.32
▸ ALOX12 P18054 1/20 0.32
▸ MAPK1 P28482 2/20 0.32
▸ BCHE P06276 1/20 0.32

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
SCHEMBL5164437 0.76 PABPC1 (0.46) PABPC1MAPTHTTKDM4EGAA
SCHEMBL11835737 0.71 MAPT (0.42) MAPTHTTIDO1TDO2NSD2
SCHEMBL11815087 0.70 DDAH1 (0.42) MAPTHTTKDM4EALDH1A1TDP1
SCHEMBL5161445 0.67 MAPT (0.41) PABPC1MAPTHTTKDM4EL3MBTL1
SCHEMBL11829765 0.67 MAPT (0.42) PABPC1MAPTHTTIDO1TDO2
Cresoquinone SCHEMBL49207 0.66 — —
SCHEMBL11242939 0.64 — —
Hydrochloric Acid SCHEMBL11650107 0.62 MEN1 (0.38) PABPC1MAPTHTTKDM4EGAA
SCHEMBL7898097 0.62 — —
SCHEMBL13903218 0.62 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3956342-A HAIR DYE, HAIR SETTING LOTION L'OREAL (FR) 1976-05-11 — — US disclosed
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