SCHEMBL6693473

SCHEMBL6693473

COc1cccc(CNc2cc(NCc3cccc(OC)c3)cc(C(F)(F)F)c2)c1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
MAPT P10636 3/20 0.56
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 2/20 0.53
GAA P10253 1/20 0.53
HIF1A Q16665 1/20 0.52
UTS2R Q9UKP6 1/20 0.49
MITF O75030 1/20 0.49
ABCB1 P08183 1/20 0.49
ABCG2 Q9UNQ0 1/20 0.49
CASR P41180 1/20 0.48
CHRM2 P08172 1/20 0.48
POLB P06746 1/20 0.47
HDAC1 Q13547 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46

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
SCHEMBL6690726 0.95 MAPT (0.52) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL6693479 0.92 MEN1 (0.59) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL6695006 0.83 MAPT (0.68) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL30691741 0.83 TRPA1 (0.49) MAPTGAAHIF1AMITF
SCHEMBL6692115 0.81 MEN1 (0.47) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL24097464 0.80 MAPT (0.68) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL1134085 0.79 HIF1A (0.76) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL30373777 0.79 HIF1A (0.76) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL6693899 0.78 P2RX1 (0.54) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL6693492 0.75 MAPT (0.69) MEN1KMT2AMAPTKDM4EALDH1A1

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-20040009973-A1 Phenylenediamine derivatives N-substituted with benzyl- or heteroarylmethyl- groups 4SC AG (DE) 2004-01-15 US disclosed
WO-2003076388-A2 BIS-ANILINE DERIVATIVES USEFUL AS POTASSIUM CHANNELS MODULATORS 4SC AG (DE) 2003-09-18 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-20040009973-A1 Phenylenediamine derivatives N-substituted with benzyl- or heteroarylmethyl- groups PAH, PNMT, OPRM1 MEN1 960/4885KMT2A 998/4885MAPT 3951/4885

“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.