SCHEMBL18804674

SCHEMBL18804674

CN(C)CCOCCOC(=O)C(N)Cc1cnc[nH]1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.52
▸ SLC7A5 Q01650 1/20 0.52
▸ HRH4 Q9H3N8 5/20 0.44
▸ HRH3 Q9Y5N1 5/20 0.44
▸ NLN Q9BYT8 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ GLA P06280 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ NFKB1 P19838 1/20 0.43
▸ THPO P40225 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ APEX1 P27695 1/20 0.43
▸ BLM P54132 1/20 0.43

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
SCHEMBL18814417 0.93 CYP3A4 (0.50) CYP3A4SLC7A5HRH4HRH3NLN
SCHEMBL18814423 0.92 HRH3 (0.50) CYP3A4SLC7A5HRH4HRH3NLN
SCHEMBL18814415 0.88 CYP3A4 (0.50) CYP3A4SLC7A5HRH4HRH3ALDH1A1
SCHEMBL18878730 0.86 CYP3A4 (0.56) CYP3A4SLC7A5HRH4HRH3ALDH1A1
SCHEMBL18814425 0.86 CYP3A4 (0.50) CYP3A4SLC7A5HRH4HRH3NLN
SCHEMBL18814416 0.86 CYP3A4 (0.50) CYP3A4SLC7A5NLN
SCHEMBL28333429 0.85 CYP3A4 (0.57) CYP3A4SLC7A5HRH4HRH3NLN
SCHEMBL18804667 0.85 CYP3A4 (0.51) CYP3A4SLC7A5HRH4HRH3NLN
SCHEMBL18814479 0.84 CYP3A4 (0.48) CYP3A4SLC7A5HRH4HRH3NLN
SCHEMBL18814424 0.84 CYP3A4 (0.48) CYP3A4SLC7A5NLN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9795566-B2 Imidazole compound and liposome containing same FUJIFILM CORPORATION (JP) 2017-10-24 — — US disclosed
US-9795566-B2 Imidazole compound and liposome containing same FUJIFILM CORPORATION (JP) 2017-10-24 — — US disclosed
EP-3170812-A1 IMIDAZOLE COMPOUND AND LIPOSOME CONTAINING SAME Fujifilm Corporation (JP) 2017-05-24 — — EP disclosed
US-20170119667-A1 IMIDAZOLE COMPOUND AND LIPOSOME CONTAINING SAME FUJIFILM CORPORATION (JP) 2017-05-04 — — US disclosed
US-20170119667-A1 IMIDAZOLE COMPOUND AND LIPOSOME CONTAINING SAME FUJIFILM CORPORATION (JP) 2017-05-04 — — 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-20170119667-A1 IMIDAZOLE COMPOUND AND LIPOSOME CONTAINING SAME NPC1L1, LETM1, STOML2 CYP3A4 2661/4885SLC7A5 76/4885HRH4 66/4885

“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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