SCHEMBL2535229

SCHEMBL2535229

Cn1cc(C=C[N+](=O)[O-])c2c(F)cc(F)cc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
PSMD14 O00487 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 9/20 0.39
MAPT P10636 9/20 0.39
HTT P42858 5/20 0.39
NPSR1 Q6W5P4 4/20 0.39
HSP90AA1 P07900 4/20 0.39
LMNA P02545 3/20 0.39
FBP1 P09467 5/20 0.37
VCP P55072 2/20 0.35
KDM4E B2RXH2 1/20 0.35
RAB9A P51151 2/20 0.34
NPC1 O15118 1/20 0.34
USP2 O75604 1/20 0.34
POLB P06746 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
MITF O75030 3/20 0.34
CYP1A2 P05177 1/20 0.34

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
SCHEMBL2535226 1.00 MEN1 (0.41) MEN1KMT2APSMD14L3MBTL1ALDH1A1
SCHEMBL28939130 0.79 ALDH1A1 (0.51) MEN1KMT2APSMD14L3MBTL1ALDH1A1
SCHEMBL2534558 0.78 PRMT1 (0.41) MEN1KMT2APSMD14L3MBTL1ALDH1A1
SCHEMBL2534560 0.78 PRMT1 (0.41) MEN1KMT2APSMD14L3MBTL1ALDH1A1
SCHEMBL2537941 0.77 ALDH1A1 (0.53) MEN1KMT2AALDH1A1HTTKDM4E
SCHEMBL13518349 0.71 FBP1 (0.47) MEN1KMT2APSMD14L3MBTL1ALDH1A1
SCHEMBL13518350 0.71 FBP1 (0.47) MEN1KMT2APSMD14L3MBTL1ALDH1A1
SCHEMBL28732117 0.69 ALDH1A1 (0.61) MEN1KMT2AALDH1A1MAPTHTT
SCHEMBL31236293 0.69 ALDH1A1 (0.61) MEN1KMT2AALDH1A1MAPTHTT
SCHEMBL14297214 0.69 ALDH1A1 (0.50) MEN1KMT2AALDH1A1MAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1859798-B1 N-(2-ARYLETHYL) BENZYLAMINES AS ANTAGONISTS OF THE 5-HT6 RECEPTOR LILLY CO ELI (US) 2015-12-30 EP disclosed
US-8044090-B2 N-(2-arylethyl)benzylamines as antagonists of the 5-HT6 receptor ELI LILLY (US) 2011-10-25 US disclosed
US-20090306110-A1 N-(2-ARYLETHYL)BENZYLAMINES AS ANTAGONISTS OF THE 5-HT6 RECEPTOR CHEN ZHAOGEN 2009-12-10 US disclosed
EP-1859798-A1 N-(2-ARYLETHYL) BENZYLAMINES AS ANTAGONISTS OF THE 5-HT6 RECEPTOR ELI LILLY AND COMPANY (US) 2007-11-28 EP disclosed
EP-1379239-B1 N-(2-ARYLETHYL) BENZYLAMINES AS ANTAGONISTS OF THE 5-HT6 RECEPTOR LILLY CO ELI (US) 2007-09-12 EP disclosed
US-20070099909-A1 N-(2-ARYLETHYL)BENZYLAMINES AS ANTAGONISTS OF THE 5-HT6 RECEPTOR CHEN ZHAOGEN 2007-05-03 US disclosed
US-7157488-B2 N-(2-Arylethyl) benzylamines as antagonists of the 5-HT6 receptor ELI LILLY AND COMPANY (US) 2007-01-02 US disclosed
US-20060009511-A9 N-(2-arylethyl) benzylamines as antagonists of the 5-ht6 receptor CHEN ZHAOGEN 2006-01-12 US disclosed
EP-1379239-A2 N-(2-ARYLETHYL) BENZYLAMINES AS ANTAGONISTS OF THE 5-HT6 RECEPTOR ELI LILLY AND COMPANY (US) 2004-01-14 EP disclosed
WO-2002078693-A2 N-(2-ARYLETHYL)BENZYLAMINES AS ANTAGONISTS OF THE 5-HT6 RECEPTOR ELI LILLY AND COMPANY (US) 2002-10-10 WO disclosed

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

For each of this compound's patents that has machine-readable text (3 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-20060009511-A9 N-(2-arylethyl) benzylamines as antagonists of the 5-ht6 receptor HTR6, HTR2C, HTR1B MEN1 1889/4885KMT2A 1269/4885PSMD14 3558/4885
US-20090306110-A1 N-(2-ARYLETHYL)BENZYLAMINES AS ANTAGONISTS OF THE 5-HT6 RECEPTOR HTR6, HTR2C, HTR1B MEN1 1889/4885KMT2A 1269/4885PSMD14 3558/4885
US-20070099909-A1 N-(2-ARYLETHYL)BENZYLAMINES AS ANTAGONISTS OF THE 5-HT6 RECEPTOR HTR6, HTR2C, HTR1B MEN1 1889/4885KMT2A 1269/4885PSMD14 3558/4885

“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.