SCHEMBL6403164

SCHEMBL6403164

Cc1nnc(SCc2ccccc2)n1Cc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.65
PDE6D O43924 1/20 0.61
ALDH1A1 P00352 6/20 0.60
TSHR P16473 2/20 0.60
NPC1 O15118 1/20 0.60
RAB9A P51151 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
KDM4E B2RXH2 5/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
OPRK1 P41145 1/20 0.54
HPGD P15428 2/20 0.54
POLB P06746 2/20 0.54
HTT P42858 2/20 0.53
NPSR1 Q6W5P4 1/20 0.52
TP53 P04637 1/20 0.51

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
SCHEMBL6411912 0.88 OPRK1 (0.64) LMNAPDE6DALDH1A1TSHRNPC1
SCHEMBL6406874 0.87 LMNA (0.65) LMNAALDH1A1TSHRNPC1RAB9A
SCHEMBL6408118 0.84 L3MBTL1 (0.67) LMNAPDE6DALDH1A1TSHRNPC1
SCHEMBL6404093 0.83 TSHR (0.74) LMNAALDH1A1TSHRNPC1RAB9A
SCHEMBL3915525 0.83 ALDH1A1 (0.67) LMNAALDH1A1TSHRNPC1RAB9A
SCHEMBL4735710 0.82 ALDH1A1 (0.71) LMNAALDH1A1SMN1; SMN2KDM4EMEN1
SCHEMBL9504656 0.80 KDM4E (0.60) LMNAALDH1A1TSHRSMN1; SMN2KDM4E
SCHEMBL11510029 0.80 ALDH1A1 (0.52) LMNAALDH1A1KDM4EMEN1KMT2A
SCHEMBL4204712 0.79 MEN1 (0.72) LMNAALDH1A1TSHRNPC1RAB9A
SCHEMBL28480818 0.78 PDE6D (0.71) PDE6DALDH1A1TSHRNPC1RAB9A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050288347-A1 Certain triazole-based compounds, compositions, and uses thereof AGRIUS GROUP, LLC. 2005-12-29 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-20050288347-A1 Certain triazole-based compounds, compositions, and uses thereof ABCG2, ATP5ME, DNTT LMNA 4116/4885PDE6D 3331/4885ALDH1A1 720/4885

“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.