SCHEMBL6706131

SCHEMBL6706131

c1ccc(C(c2ccccc2)N2CCN(c3ncnc4c3cnn4-c3ccccc3)CC2)cc1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.71
NPC1 O15118 5/20 0.71
RAB9A P51151 5/20 0.71
MAPK1 P28482 2/20 0.71
NPSR1 Q6W5P4 1/20 0.71
ALDH1A1 P00352 7/20 0.70
SMN1; SMN2 Q16637 3/20 0.70
HPGD P15428 2/20 0.70
MEN1 O00255 1/20 0.67
KMT2A Q03164 1/20 0.67
KDM4E B2RXH2 1/20 0.66
SLC2A1 P11166 8/20 0.65
SLC2A3 P11169 8/20 0.65
SLC2A2 P11168 7/20 0.65
LMNA P02545 3/20 0.65
POLB P06746 1/20 0.62
HSD17B10 Q99714 1/20 0.62

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
SCHEMBL21568696 0.82 MAPT (1.00) MAPTNPC1RAB9AMAPK1NPSR1
SCHEMBL29618261 0.82 MAPT (1.00) MAPTNPC1RAB9AMAPK1NPSR1
SCHEMBL7658416 0.81 MAPT (0.80) MAPTNPC1RAB9AMAPK1NPSR1
SCHEMBL2628836 0.80 SLC2A1 (0.77) MAPTNPC1RAB9AMAPK1NPSR1
SCHEMBL2628843 0.80 MAPT (0.80) MAPTNPC1RAB9AMAPK1NPSR1
SCHEMBL13390339 0.76 MAPT (0.67) MAPTNPC1RAB9AMAPK1NPSR1
SCHEMBL13576575 0.74 ALDH1A1 (0.69) MAPTNPC1RAB9AMAPK1NPSR1
SCHEMBL24533665 0.73 NPC1 (0.78) MAPTNPC1RAB9AMAPK1NPSR1
SCHEMBL15176822 0.73 ALDH1A1 (0.67) MAPTNPC1RAB9AMAPK1NPSR1
SCHEMBL23024507 0.71 MAPT (0.59) MAPTNPC1RAB9AMAPK1NPSR1

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-6815444-B2 Anti-enterovirus compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2004-11-09 US disclosed
US-20040204400-A1 ANTI-ENTEROVIRUS COMPOUNDS NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2004-10-14 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-20040204400-A1 ANTI-ENTEROVIRUS COMPOUNDS NR2E1, NR4A1, NR0B1 MAPT 4721/4885NPC1 1786/4885RAB9A 2934/4885

“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.