SCHEMBL16350339

SCHEMBL16350339

CCN1c2cccc3cccc(c23)N(CC)C12CCC(C)CC2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.41
▸ KDM4E B2RXH2 8/20 0.41
▸ HPGD P15428 6/20 0.41
▸ GAA P10253 5/20 0.41
▸ ALOX12 P18054 1/20 0.41
▸ MAPT P10636 7/20 0.39
▸ NSD2 O96028 2/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ APP P05067 1/20 0.38
▸ SNCA P37840 1/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ CASP1 P29466 1/20 0.36
▸ MPI P34949 1/20 0.36
▸ CACNA1B Q00975 1/20 0.36
▸ APBA1 Q02410 1/20 0.36
▸ MEN1 O00255 4/20 0.34
▸ KMT2A Q03164 4/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ ACHE P22303 2/20 0.33
▸ POLB P06746 1/20 0.33

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
SCHEMBL9613275 0.82 ATM (0.34) SMN1; SMN2ACHE
SCHEMBL22856763 0.80 GAA (0.53) ALDH1A1KDM4EHPGDGAAALOX12
SCHEMBL24073131 0.73 KDM4E (0.52) ALDH1A1KDM4EHPGDGAAALOX12
SCHEMBL17167123 0.73 KDM4E (0.62) ALDH1A1KDM4EHPGDGAAALOX12
SCHEMBL9649346 0.65 KDM4E (0.37) ALDH1A1KDM4EHPGDGAAALOX12
SCHEMBL9613365 0.64 KDM4E (0.37) ALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL8746608 0.64 KDM4E (0.42) ALDH1A1KDM4EHPGDGAAALOX12
SCHEMBL26209029 0.64 KDM4E (0.53) ALDH1A1KDM4EHPGDGAAALOX12
SCHEMBL12114738 0.62 GAA (0.34) ALDH1A1KDM4EHPGDGAAMAPT
SCHEMBL22510027 0.62 ALDH1A1 (0.36) ALDH1A1KDM4EHPGDGAAALOX12

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-8053039-B2 Polymerizable dichroic azo dyes ROLIC AG (CH) 2011-11-08 — — US disclosed
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