SCHEMBL6715345

SCHEMBL6715345

CCN(CC)c1cccc(C(=O)c2ccc(C(=[N+]=[N-])c3ccccc3)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
HPGD P15428 2/20 0.46
L3MBTL1 Q9Y468 4/20 0.44
TDP1 Q9NUW8 2/20 0.44
MAOB P27338 1/20 0.44
ATM Q13315 1/20 0.44
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPK1 P28482 2/20 0.41
LMNA P02545 1/20 0.41
GRM2 Q14416 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
PBRM1 Q86U86 1/20 0.39
CNR2 P34972 1/20 0.39
HSD11B1 P28845 1/20 0.39
HDAC6 Q9UBN7 1/20 0.38
USP2 O75604 1/20 0.38

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
SCHEMBL610585 0.87 L3MBTL1 (0.57) ALDH1A1HPGDL3MBTL1TDP1MAOB
SCHEMBL25206262 0.83 ALDH1A1 (0.51) ALDH1A1HPGDL3MBTL1TDP1MAOB
SCHEMBL2742811 0.83 ALDH1A1 (0.58) ALDH1A1HPGDL3MBTL1TDP1MAOB
SCHEMBL3227770 0.77 MAOB (0.45) MAOBKMT2ASMN1; SMN2TSHRNOX1
Benzophenone SCHEMBL10489584 0.76 HPGD (0.63) ALDH1A1HPGDTDP1MAOBMEN1
SCHEMBL51623 0.76 HPGD (0.63) ALDH1A1HPGDTDP1MAOBMEN1
SCHEMBL11782996 0.76 L3MBTL1 (0.53) ALDH1A1HPGDL3MBTL1TDP1ATM
SCHEMBL9620455 0.75 HPGD (0.50) ALDH1A1HPGDL3MBTL1TDP1MAOB
SCHEMBL872529 0.75 ALDH1A1 (0.56) ALDH1A1HPGDL3MBTL1TDP1MEN1
SCHEMBL28067618 0.74 SMN1; SMN2 (0.55) ALDH1A1HPGDL3MBTL1NPC1RAB9A

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-20040127691-A1 Process for surface functionalsation of polymeric substrates using diaryl carbenes as reactive intermediates MOLONEY MARK GERARD (GB) 2004-07-01 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040127691-A1 Process for surface functionalsation of polymeric substrates using diaryl carbenes as reactive intermediates CYCS, CTTN, CYBB ALDH1A1 451/4885HPGD 3187/4885L3MBTL1 4792/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.