SCHEMBL6754353

SCHEMBL6754353

O=C(Nc1cnc(NCc2ccccn2)c(Cl)c1)c1cccc2c1[nH]c1ccccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.42
GLA P06280 1/20 0.42
HTT P42858 1/20 0.42
AURKA O14965 1/20 0.42
RPS6KB1 P23443 1/20 0.42
HTR2C P28335 1/20 0.42
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
CHUK O15111 2/20 0.41
ICOSLG O75144 2/20 0.41
ICOS Q9Y6W8 2/20 0.41
NPC1 O15118 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
RXFP1 Q9HBX9 1/20 0.41
KDR P35968 3/20 0.40
GAA P10253 1/20 0.40
MAPK1 P28482 1/20 0.40
POLB P06746 1/20 0.39
ALOX15 P16050 1/20 0.39

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
SCHEMBL6759807 0.92 KMT2A (0.43) MAPTGLAHTTAURKARPS6KB1
SCHEMBL6756593 0.88 RAB9A (0.44) MAPTGLAHTTAURKARPS6KB1
SCHEMBL6759896 0.86 HDAC3 (0.48) MAPTAURKARPS6KB1HTR2CALDH1A1
SCHEMBL6756672 0.83 HTR2C (0.48) MAPTAURKARPS6KB1HTR2CALDH1A1
SCHEMBL6754321 0.77 GLA (0.42) MAPTGLAHTTALDH1A1HPGD
SCHEMBL6756556 0.76 HTR2C (0.71) HTR2CPARP14
SCHEMBL6754374 0.75 NPC1 (0.46) MAPTGLAHTTALDH1A1NPC1
SCHEMBL6756561 0.73 NPC1 (0.49) MAPTGLAHTTHPGDNPC1
SCHEMBL6759818 0.71 NPC1 (0.53) MAPTGLAHTTHPGDNPC1
SCHEMBL6754358 0.71 AURKA (0.50) AURKARPS6KB1MEN1KMT2AKDR

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-20040087798-A1 Novel amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-05-06 US disclosed
EP-1264820-A1 NOVEL AMIDE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-12-11 EP 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-20040087798-A1 Novel amide compounds H1-2, H1-0, H1-3 MAPT 3247/4885GLA 3175/4885HTT 2432/4885

“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.