SCHEMBL6406900

SCHEMBL6406900

Fc1ccccc1Oc1ccnc(-c2ccccc2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.47
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
MAP4K4 O95819 1/20 0.45
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ALOX5AP P20292 6/20 0.41
FEN1 P39748 6/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
MAPT P10636 1/20 0.40
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
FFAR4 Q5NUL3 2/20 0.38
TRPA1 O75762 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
NPC1 O15118 1/20 0.36
PKM P14618 1/20 0.36
NFKB1 P19838 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL5119716 0.78 MAPK1 (0.59) MAPK1MEN1KMT2AKDM4EALDH1A1
SCHEMBL29692779 0.76 NPSR1 (0.48) MAPK1MEN1KMT2AMAP4K4KDM4E
SCHEMBL28796725 0.76 NPSR1 (0.48) MAPK1MEN1KMT2AMAP4K4KDM4E
SCHEMBL14658657 0.74 MEN1 (0.44) MEN1KMT2AMAP4K4KDM4EALDH1A1
SCHEMBL15483941 0.73 KMT2A (0.50) MAPK1MEN1KMT2AKDM4EALDH1A1
SCHEMBL8026938 0.73 MAPK1 (0.43) MAPK1MEN1KMT2AKDM4ENPSR1
SCHEMBL29524578 0.73 KMT2A (0.50) MAPK1MEN1KMT2AKDM4EALDH1A1
SCHEMBL6406892 0.72 MAPT (0.50) MAPK1MEN1KMT2AKDM4EALOX5AP
SCHEMBL468007 0.72 P2RY1 (0.42) KMT2AALOX5APFEN1
SCHEMBL18984674 0.71 MEN1 (0.59) MEN1KMT2AMAP4K4KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6867210-B2 Aryl substituted pyrimidines EURO-CELTIQUE S.A. (LU) 2005-03-15 US disclosed
US-20050043305-A1 Aryl substituted pyridines, pyrimidines, pyrazines and triazines and the use thereof EURO-CELTIQUE S.A. (LU) 2005-02-24 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-20050043305-A1 Aryl substituted pyridines, pyrimidines, pyrazines and triazines and the use thereof CACNA1S, CACNA1C, KYNU MAPK1 2349/4885MEN1 4858/4885KMT2A 3260/4885

“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.