SCHEMBL5282413

SCHEMBL5282413

CCCCC1N(CC)C=CN1Cc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.40
RIN1 Q13671 1/20 0.40
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
KMT2A Q03164 1/20 0.38
HRH3 Q9Y5N1 1/20 0.37
SIGMAR1 Q99720 1/20 0.36
CYP19A1 P11511 3/20 0.35
POLB P06746 1/20 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
SCHEMBL5291444 0.95 ALDH1A1 (0.43) ABL1RIN1MEN1ALDH1A1KMT2A
SCHEMBL5297231 0.94 MEN1 (0.42) ABL1RIN1MEN1ALDH1A1KMT2A
SCHEMBL5299047 0.94 MEN1 (0.42) ABL1RIN1MEN1ALDH1A1KMT2A
SCHEMBL5816588 0.94 MEN1 (0.42) ABL1RIN1MEN1ALDH1A1KMT2A
SCHEMBL5817764 0.94 MEN1 (0.42) ABL1RIN1MEN1ALDH1A1KMT2A
SCHEMBL5282807 0.94 MEN1 (0.42) ABL1RIN1MEN1ALDH1A1KMT2A
SCHEMBL5292209 0.94 MEN1 (0.42) ABL1RIN1MEN1ALDH1A1KMT2A
SCHEMBL5302609 0.94 MEN1 (0.42) ABL1RIN1MEN1ALDH1A1KMT2A
SCHEMBL5810745 0.94 MEN1 (0.42) ABL1RIN1MEN1ALDH1A1KMT2A
SCHEMBL5816177 0.94 MEN1 (0.42) ABL1RIN1MEN1ALDH1A1KMT2A

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