SCHEMBL6255267

SCHEMBL6255267

Cc1ccccc1NC1CCCCNCC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 3/20 0.48
▸ ATAD2 Q6PL18 3/20 0.48
▸ MAPT P10636 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ CYP1A2 P05177 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ KDM1A O60341 1/20 0.44
▸ HTR2C P28335 2/20 0.44
▸ KHK P50053 2/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ CRHBP P24387 1/20 0.41
▸ CRHR2 Q13324 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ NSD2 O96028 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
SCHEMBL82901 0.92 BRD4 (0.54) BRD4ATAD2MAPTKDM4EGAA
Hydrochloric Acid SCHEMBL68445 0.90 BRD4 (0.52) BRD4ATAD2MAPTKDM4EGAA
SCHEMBL21392344 0.87 KDM4E (0.58) MAPTKDM4EGAAHSD17B10ALDH1A1
SCHEMBL23016004 0.85 GAA (0.61) MAPTKDM4EGAAKMT2AALDH1A1
SCHEMBL7634561 0.85 GAA (0.61) MAPTKDM4EGAAKMT2AALDH1A1
SCHEMBL27583230 0.83 PRKCZ (0.52) BRD4ATAD2KDM1A
SCHEMBL27322594 0.82 BRD4 (0.56) BRD4ATAD2CYP1A2MEN1CYP3A4
SCHEMBL5202907 0.79 MAPT (0.47) MAPTKDM4EGAACYP1A2CYP3A4
SCHEMBL82566 0.79 BRD4 (0.55) BRD4ATAD2MAPTGAACYP1A2
Bicarbonate SCHEMBL11086979 0.78 P2RX7 (0.55) MAPTKDM4EGAAMEN1KMT2A

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
WO-2005068431-A1 COMPOSITION FOR DYEING KERATIN FIBRES, COMPRISING AT LEAST ONE PARA-PHENYLENEDIAMINE DERIVATIVE L'OREAL (FR) 2005-07-28 — — WO claimed
WO-2005068431-A1 COMPOSITION FOR DYEING KERATIN FIBRES, COMPRISING AT LEAST ONE PARA-PHENYLENEDIAMINE DERIVATIVE L'OREAL (FR) 2005-07-28 — — WO disclosed
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