SCHEMBL11630157

SCHEMBL11630157

CCN(CCN1CCCCC1)c1ccc(N=C2C=C(Cl)C(=O)C=C2NC(C)=O)cc1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ GFER P55789 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ EPHX2 P34913 3/20 0.34
▸ HRH3 Q9Y5N1 3/20 0.33
▸ PDK1 Q15118 1/20 0.33
▸ POLB P06746 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ CNR1 P21554 1/20 0.30

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
SCHEMBL11629140 0.80 BACE1 (0.35) KDM4EMEN1KMT2ALMNA
SCHEMBL11626213 0.77 ALDH1A1 (0.34) KDM4EALDH1A1MEN1GFERKMT2A
SCHEMBL5511244 0.69 MEN1 (0.42) KDM4EALDH1A1MEN1GFERKMT2A
SCHEMBL5511241 0.69 MEN1 (0.42) KDM4EALDH1A1MEN1GFERKMT2A
SCHEMBL12106906 0.69 GHSR (0.36) KDM4EALDH1A1MEN1GFERKMT2A
SCHEMBL260979 0.68 ALDH1A1 (0.40) KDM4EALDH1A1MEN1GFERKMT2A
SCHEMBL11625741 0.68 GFER (0.37) KDM4EALDH1A1MEN1GFERKMT2A
SCHEMBL11629500 0.68 BACE1 (0.33) KDM4EMEN1KMT2ALMNA
SCHEMBL12106921 0.68 ALDH1A1 (0.38) KDM4EALDH1A1MEN1GFERKMT2A
SCHEMBL12106907 0.67 MAPT (0.32) KDM4EALDH1A1MEN1KMT2AMAPT

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-4093806-A HAIR DYES L'OREAL (FR) 1978-06-06 — — US disclosed
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