SCHEMBL11626213

SCHEMBL11626213

CCN(CCN1CCCCC1)c1ccc(N=C2C(C)=CC(=O)C(NC(C)=O)=C2C)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ KMT2A Q03164 6/20 0.33
▸ MEN1 O00255 5/20 0.33
▸ GFER P55789 3/20 0.33
▸ LMNA P02545 3/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ CYP2D6 P10635 1/20 0.31
▸ GAA P10253 2/20 0.31
▸ MAPT P10636 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ EPHX2 P34913 2/20 0.31
▸ TSHR P16473 1/20 0.31
▸ MAPK1 P28482 1/20 0.30
▸ OPRM1 P35372 1/20 0.30
▸ OPRD1 P41143 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ NPSR1 Q6W5P4 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
SCHEMBL11625741 0.83 GFER (0.37) ALDH1A1KDM4EKMT2AMEN1GFER
SCHEMBL11626015 0.80 MEN1 (0.32) ALDH1A1KMT2AMEN1GFERGAA
SCHEMBL11627038 0.80 KMT2A (0.33) ALDH1A1KMT2AMEN1GFERLMNA
SCHEMBL11630157 0.77 KDM4E (0.36) ALDH1A1KDM4EKMT2AMEN1GFER
SCHEMBL11306613 0.76 PABPC1 (0.43) ALDH1A1KDM4EKMT2AMEN1LMNA
SCHEMBL11627931 0.74 GAA (0.39) ALDH1A1KDM4EKMT2AMEN1GFER
SCHEMBL11409533 0.72 MAPT (0.43) ALDH1A1KDM4EKMT2AMEN1LMNA
SCHEMBL11626450 0.69 MAPT (0.32) ALDH1A1KDM4EKMT2AGAAMAPT
SCHEMBL12663039 0.67 ALDH1A1 (0.55) ALDH1A1KDM4EKMT2AMEN1GFER
SCHEMBL11321038 0.67 PABPC1 (0.42) ALDH1A1KDM4EKMT2AMEN1LMNA

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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