SCHEMBL6693953

SCHEMBL6693953

COc1cccc(CNc2cccc(NCc3ccc(F)cc3Cl)c2)c1

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.65
MEN1 O00255 4/20 0.65
KMT2A Q03164 4/20 0.65
HIF1A Q16665 1/20 0.51
MAOB P27338 1/20 0.50
GAA P10253 2/20 0.49
BCHE P06276 1/20 0.49
ACHE P22303 1/20 0.49
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
PTGER3 P43115 1/20 0.48
NOS1 P29475 1/20 0.46
P2RX7 Q99572 1/20 0.46
HDAC4 P56524 2/20 0.46
MEF2D Q14814 2/20 0.46
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ABCB1 P08183 1/20 0.45
ABCG2 Q9UNQ0 1/20 0.45

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
SCHEMBL6695981 0.84 LMNA (0.51) MAPTMEN1KMT2AMAOBGAA
SCHEMBL6691549 0.83 TP53 (0.48) MAPTMEN1KMT2AMAOBKDM4E
SCHEMBL24097464 0.82 MAPT (0.68) MAPTMEN1KMT2AHIF1AGAA
SCHEMBL6695006 0.82 MAPT (0.68) MAPTMEN1KMT2AHIF1AMAOB
SCHEMBL6693492 0.79 MAPT (0.69) MAPTMEN1KMT2AHIF1AGAA
SCHEMBL631899 0.78 MAPT (0.71) MAPTMEN1KMT2AHIF1AGAA
SCHEMBL17605113 0.78 MEN1 (0.64) MAPTMEN1KMT2AMAOBGAA
SCHEMBL6694596 0.76 TP53 (0.54) MAPTMEN1KMT2AMAOBALDH1A1
SCHEMBL6693433 0.75 BRD4 (0.49) MAPTMEN1KMT2AGAALMNA
SCHEMBL14433869 0.75 MEN1 (0.69) MAPTMEN1KMT2AMAOBGAA

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 MAPT 3951/4885MEN1 960/4885KMT2A 998/4885

“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.