SCHEMBL11318605

SCHEMBL11318605

Nc1ccc(N(N)Cc2ccco2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.49
▸ ALOX5 P09917 1/20 0.45
▸ TAAR1 Q96RJ0 1/20 0.40
▸ TSHR P16473 4/20 0.38
▸ MAPT P10636 3/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ GFER P55789 1/20 0.38
▸ HTT P42858 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ CASP1 P29466 1/20 0.37
▸ CASP7 P55210 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ TP53 P04637 2/20 0.36
▸ RIPK1 Q13546 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ CYP1A2 P05177 2/20 0.35
▸ CYP3A4 P08684 2/20 0.35

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
SCHEMBL1498696 0.84 GAA (0.50) GAAALOX5TAAR1TSHRMAPT
SCHEMBL5931188 0.71 — —
SCHEMBL6952454 0.69 KDM4E (0.56) ALOX5MAPTHTTALOX15KDM4E
SCHEMBL9376259 0.68 GFER (0.56) GAATAAR1TSHRMAPTSMN1; SMN2
SCHEMBL11318602 0.68 KDM4E (0.35) TSHRMAPTKDM4EALDH1A1CYP1A2
SCHEMBL10501644 0.67 ALOX5 (0.51) ALOX5MAPTHTTKDM4ETP53
SCHEMBL28948440 0.66 KDM4E (0.51) ALOX5MAPTGFERHTTMEN1
SCHEMBL733240 0.66 — —
SCHEMBL11669014 0.66 ALOX5 (0.46) ALOX5TSHRMAPTSMN1; SMN2HTT
SCHEMBL8816431 0.66 GAA (1.00) GAATAAR1TSHRMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4295848-A Composition for hair dyeing which contains a para base and an ortho base L'OREAL (FR) 1981-10-20 — — US disclosed
US-4268264-A ORTHO PRECURSORS SELECTED FROM AROMATIC DIAMINES, AMINOPHENOL, DIPHENOL, AND PHENYLENEDIAMINE L'OREAL (FR) 1981-05-19 — — US disclosed
Send feedback