SCHEMBL11520111

SCHEMBL11520111

CCN(CC)c1ccc(C2c3ccc(N(CC)CC)cc3Oc3cc(N(CC)CC)ccc32)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.48
KMT2A Q03164 8/20 0.48
TSHR P16473 4/20 0.48
CYP3A4 P08684 4/20 0.48
NPSR1 Q6W5P4 4/20 0.48
CASP1 P29466 4/20 0.48
CASP7 P55210 4/20 0.48
GAA P10253 4/20 0.48
HTT P42858 3/20 0.48
USP2 O75604 2/20 0.48
BRCA1 P38398 2/20 0.48
NPC1 O15118 2/20 0.48
CYP2C9 P11712 2/20 0.48
CYP2C19 P33261 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
HBB P68871 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
ALDH1A1 P00352 12/20 0.43
L3MBTL1 Q9Y468 8/20 0.43

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
SCHEMBL8778047 0.92 NPSR1 (0.46) MEN1KMT2ATSHRCYP3A4NPSR1
SCHEMBL11289610 0.92 MEN1 (0.46) MEN1KMT2ATSHRCYP3A4NPSR1
SCHEMBL82135 0.91 MEN1 (0.52) MEN1KMT2ATSHRCYP3A4NPSR1
Nitric Acid SCHEMBL27979944 0.89 MEN1 (0.44) MEN1KMT2ATSHRCYP3A4NPSR1
SCHEMBL18213659 0.86 KMT2A (0.42) MEN1KMT2ATSHRCYP3A4NPSR1
SCHEMBL9659502 0.83 MEN1 (0.47) MEN1KMT2ATSHRCYP3A4NPSR1
Nitric Acid SCHEMBL27979826 0.82 ALDH1A1 (0.48) MEN1KMT2ATSHRCYP3A4NPSR1
SCHEMBL9803843 0.81 ALDH1A1 (0.47) MEN1KMT2ATSHRCYP3A4NPSR1
SCHEMBL3896114 0.81 MEN1 (0.43) MEN1KMT2ATSHRCYP3A4NPSR1
SCHEMBL27979822 0.80 MEN1 (0.42) MEN1KMT2ATSHRCYP3A4NPSR1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4139390-A Presensitized printing plate having a print-out image EASTMAN KODAK COMPANY (US) 1979-02-13 US claimed
EP-1588858-B1 Lithographic printing plate precursor and lithographic printing method FUJIFILM CORP (JP) 2007-08-08 EP disclosed
US-4139390-A Presensitized printing plate having a print-out image EASTMAN KODAK COMPANY (US) 1979-02-13 US disclosed