SCHEMBL4986967

SCHEMBL4986967

CC(=O)Nc1[c]nncc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.36
HSD17B10 Q99714 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
GAA P10253 1/20 0.36
PKM P14618 1/20 0.36
ALOX15 P16050 1/20 0.36
HTT P42858 1/20 0.36
NAPRT Q6XQN6 1/20 0.36
KDM4E B2RXH2 3/20 0.36
LMNA P02545 1/20 0.36
MEN1 O00255 3/20 0.35
ALDH1A1 P00352 3/20 0.35
KMT2A Q03164 3/20 0.35
TSHR P16473 2/20 0.35
MAPT P10636 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
CA12 O43570 1/20 0.35
BRD4 O60885 1/20 0.35
NR1I2 O75469 1/20 0.35
CA1 P00915 1/20 0.35

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
SCHEMBL4988302 0.81 SMN1; SMN2 (0.39) SMN1; SMN2HSD17B10GAAPKMHTT
SCHEMBL7411343 0.74
SCHEMBL429672 0.69 TSHR (0.42) SMN1; SMN2HSD17B10L3MBTL1GAAPKM
SCHEMBL11735364 0.68 PTK2 (0.40) SMN1; SMN2HSD17B10L3MBTL1GAAPKM
SCHEMBL11296558 0.67 L3MBTL1 (0.44) SMN1; SMN2HSD17B10L3MBTL1GAAPKM
SCHEMBL2161029 0.64 HSD17B10 (0.48) SMN1; SMN2HSD17B10L3MBTL1GAAPKM
SCHEMBL30571106 0.64 SMN1; SMN2 (0.48) SMN1; SMN2HSD17B10L3MBTL1HTTNAPRT
SCHEMBL12844929 0.64 SMN1; SMN2 (0.48) SMN1; SMN2HSD17B10L3MBTL1HTTNAPRT
SCHEMBL4418275 0.63 GLS (0.58) SMN1; SMN2HSD17B10L3MBTL1GAAPKM
SCHEMBL1430882 0.63 GOT1 (0.50) HSD17B10L3MBTL1HTTNAPRTKDM4E

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-20080125409-A1 1,5-Diheterocycle-1H-Triazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2008-05-29 US disclosed
EP-1803719-A1 1,5-DIHETEROCYCLE-1H-TRIAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-07-04 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-20080125409-A1 1,5-Diheterocycle-1H-Triazole Derivative PTGS1, PTGER1, TBXA2R SMN1; SMN2 3713/4885HSD17B10 1033/4885L3MBTL1 4631/4885

“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.