SCHEMBL5282807

SCHEMBL5282807

CCCCCCCCCCCC1N(CC)C=CN1Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP19A1 P11511 3/20 0.40
ABL1 P00519 1/20 0.38
RIN1 Q13671 1/20 0.38
KCNH2 Q12809 2/20 0.38
NPC1 O15118 1/20 0.37
DNM1 Q05193 2/20 0.37
TP53 P04637 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
EPHX2 P34913 1/20 0.36
PKM P14618 1/20 0.36
KCNA3 P22001 1/20 0.36
HTT P42858 2/20 0.36

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
SCHEMBL5809900 1.00 MEN1 (0.42) MEN1KMT2AALDH1A1CYP19A1ABL1
SCHEMBL5817764 1.00 MEN1 (0.42) MEN1KMT2AALDH1A1CYP19A1ABL1
SCHEMBL5816588 1.00 MEN1 (0.42) MEN1KMT2AALDH1A1CYP19A1ABL1
SCHEMBL5816580 1.00 MEN1 (0.42) MEN1KMT2AALDH1A1CYP19A1ABL1
SCHEMBL5302609 1.00 MEN1 (0.42) MEN1KMT2AALDH1A1CYP19A1ABL1
SCHEMBL5810745 1.00 MEN1 (0.42) MEN1KMT2AALDH1A1CYP19A1ABL1
SCHEMBL5297231 1.00 MEN1 (0.42) MEN1KMT2AALDH1A1CYP19A1ABL1
SCHEMBL5292209 1.00 MEN1 (0.42) MEN1KMT2AALDH1A1CYP19A1ABL1
SCHEMBL5299047 1.00 MEN1 (0.42) MEN1KMT2AALDH1A1CYP19A1ABL1
SCHEMBL5811728 1.00 MEN1 (0.42) MEN1KMT2AALDH1A1CYP19A1ABL1

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-2007006418-A1 IONIC-LIQUID-CONTAINING PRODUCTS FOR DYEING AND/OR BRIGHTENING KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-01-18 WO disclosed
WO-2006131234-A1 COSMETIC COMPOSITIONS COMPRISING IONIC LIQUIDS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-12-14 WO disclosed