SCHEMBL13490255

SCHEMBL13490255

Cc1ccc(N2C=CN(c3ccc(C)cc3C)C2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.40
ALDH1A1 P00352 3/20 0.36
MAPT P10636 4/20 0.36
MCOLN3 Q8TDD5 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
KDM4E B2RXH2 2/20 0.34
HTT P42858 4/20 0.34
LMNA P02545 4/20 0.34
POLB P06746 1/20 0.34
MAPK1 P28482 1/20 0.34
TSHR P16473 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HSD17B10 Q99714 1/20 0.33
NPC1 O15118 1/20 0.33
PKM P14618 1/20 0.33
RAB9A P51151 1/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL18138107 0.91 NPSR1 (0.46) NPSR1ALDH1A1MAPTMCOLN3MEN1
Iodide SCHEMBL28684985 0.89 NPSR1 (0.44) NPSR1ALDH1A1MAPTMCOLN3MEN1
SCHEMBL223853 0.82 MAPT (0.42) NPSR1ALDH1A1MAPTKDM4EHTT
SCHEMBL18538762 0.82 NPSR1 (0.40) NPSR1ALDH1A1MAPTMCOLN3MEN1
Hydrochloric Acid SCHEMBL820585 0.80 MAPT (0.41) NPSR1ALDH1A1MAPTKDM4EHTT
SCHEMBL27868503 0.75 LMNA (0.42) NPSR1ALDH1A1MAPTKDM4EHTT
Bromide SCHEMBL1885409 0.75 NPSR1 (0.37) NPSR1ALDH1A1MAPTMCOLN3MEN1
SCHEMBL13490256 0.71 ALDH1A1 (0.50) NPSR1ALDH1A1MAPTMCOLN3MEN1
SCHEMBL27196390 0.71 MAPT (0.42) NPSR1ALDH1A1MAPTKDM4EHTT
SCHEMBL12514330 0.70 ALDH1A1 (0.41) ALDH1A1MAPTMCOLN3MEN1KMT2A

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
EP-2139907-B1 ELECTROLUMINESCENT METAL COMPLEX BASF SE (DE) 2013-08-14 EP disclosed
US-20100044688-A1 ELECTROLUMINESCENT METAL COMPLEX CIBA CORPORATION (US) 2010-02-25 US disclosed
WO-2009087064-A1 ELECTROLUMINESCENT IONIC HOST-GUEST DENDRITIC MATERIALS BASF SE (DE) 2009-07-16 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 (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-20100044688-A1 ELECTROLUMINESCENT METAL COMPLEX LDHA, LDHB, NRP1 NPSR1 1148/4885ALDH1A1 233/4885MAPT 4595/4885

“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.