SCHEMBL4698013

SCHEMBL4698013

COc1ccc(C=NNC(N)=NCc2ccccc2)c(Cl)c1OC

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.46
RXFP3 Q9NSD7 3/20 0.45
KDM4E B2RXH2 5/20 0.45
ALOX12 P18054 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
REN P00797 1/20 0.43
CTSD P07339 1/20 0.43
POLB P06746 1/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
HTT P42858 1/20 0.42
LMNA P02545 3/20 0.41
GAA P10253 1/20 0.41
ADORA2A P29274 1/20 0.40

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
SCHEMBL4699459 0.83 MAPT (0.49) MAPTRXFP3KDM4EALOX12NPSR1
SCHEMBL914992 0.81 MAPT (0.54) MAPTKDM4EALOX12NPSR1MEN1
SCHEMBL4697826 0.81 MAPT (0.54) MAPTKDM4EALOX12NPSR1MEN1
SCHEMBL4697716 0.79 MAPT (0.52) MAPTKDM4EMEN1KMT2APOLB
SCHEMBL4701725 0.78 KMT2A (0.53) MAPTKDM4EMEN1KMT2APOLB
SCHEMBL4698010 0.78 KMT2A (0.53) MAPTKDM4EMEN1KMT2APOLB
SCHEMBL530029 0.78 MAPT (0.55) MAPTKDM4EALOX12NPSR1MEN1
SCHEMBL529833 0.78 MAPT (0.55) MAPTKDM4EALOX12NPSR1MEN1
Acetic Acid SCHEMBL915011 0.75 MAPT (0.56) MAPTKDM4EMEN1KMT2APOLB
Acetic Acid SCHEMBL915013 0.75 MAPT (0.56) MAPTKDM4EMEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1309544-B1 COMPOUNDS ACTING AS MELANOCORTIN RECEPTOR LIGANDS ACURE PHARMA AB (SE) 2008-11-05 EP claimed
US-7153881-B2 Compounds acting as melanocortin receptor ligands ACURE PHARMA AB (SE) 2006-12-26 US claimed
EP-1309544-B1 COMPOUNDS ACTING AS MELANOCORTIN RECEPTOR LIGANDS ACURE PHARMA AB (SE) 2008-11-05 EP disclosed
US-7153881-B2 Compounds acting as melanocortin receptor ligands ACURE PHARMA AB (SE) 2006-12-26 US disclosed
US-20040019094-A1 Compounds acting as melanocortin receptor ligands HPF IP HOLDING S.A. (LU) 2004-01-29 US 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-20040019094-A1 Compounds acting as melanocortin receptor ligands MC1R, MC3R, MC5R MAPT 3667/4885RXFP3 202/4885KDM4E 3828/4885

“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.