SCHEMBL6406472

SCHEMBL6406472

CCn1c(S)nnc1CNc1cccc(C(F)(F)F)c1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.52
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ SLC27A1 Q6PCB7 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ KDM4E B2RXH2 2/20 0.44
▸ GAA P10253 2/20 0.43
▸ MAPT P10636 3/20 0.43
▸ TSHR P16473 2/20 0.43
▸ BRD4 O60885 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ ROCK2 O75116 1/20 0.41
▸ GRK2 P25098 1/20 0.41
▸ RORC P51449 1/20 0.41
▸ P2RX3 P56373 1/20 0.40
▸ IDH2 P48735 1/20 0.39
▸ HTT P42858 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
SCHEMBL14680354 0.85 LMNA (0.60) LMNAMEN1KMT2AALDH1A1KDM4E
SCHEMBL6408598 0.81 LMNA (0.61) LMNAALDH1A1KDM4EGAAMAPT
SCHEMBL4202684 0.78 LMNA (0.73) LMNAMEN1KMT2ASLC27A1ALDH1A1
SCHEMBL9224408 0.72 LMNA (0.56) LMNAMEN1KMT2AALDH1A1KDM4E
SCHEMBL30490047 0.70 LMNA (0.53) LMNAMEN1KMT2AALDH1A1GAA
SCHEMBL42000 0.70 LMNA (0.53) LMNAMEN1KMT2AALDH1A1GAA
SCHEMBL1419865 0.70 LMNA (0.56) LMNAMEN1KMT2AALDH1A1GAA
Hydrochloric Acid SCHEMBL8887020 0.69 LMNA (0.51) LMNAMEN1KMT2AALDH1A1GAA
Bromide SCHEMBL29203649 0.69 LMNA (0.51) LMNAMEN1KMT2AALDH1A1GAA
SCHEMBL10055021 0.69 NPSR1 (0.55) LMNAMEN1KMT2AALDH1A1KDM4E

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 4116/4885MEN1 3562/4885KMT2A 2263/4885

“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.

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