SCHEMBL6498422

SCHEMBL6498422

COC(=O)NC1Cc2cc(N)cc(N)c2C1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 2/20 0.40
▸ CA2 P00918 2/20 0.40
▸ ACHE P22303 1/20 0.40
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ APOB P04114 6/20 0.34
▸ MTTP P55157 6/20 0.34
▸ SMO Q99835 3/20 0.34
▸ CA12 O43570 1/20 0.34
▸ CA7 P43166 1/20 0.34
▸ CA9 Q16790 1/20 0.34
▸ CA14 Q9ULX7 1/20 0.34
▸ MTNR1A P48039 2/20 0.34
▸ MTNR1B P49286 2/20 0.34

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
SCHEMBL6198196 0.79 CA1 (0.47) CA1CA2MEN1KMT2AAPOB
SCHEMBL6199831 0.79 CA1 (0.47) CA1CA2MEN1KMT2AAPOB
SCHEMBL4231484 0.79 CA1 (0.47) CA1CA2MEN1KMT2AAPOB
Hydrochloric Acid SCHEMBL6203128 0.78 CA1 (0.46) CA1CA2MEN1KMT2AAPOB
Hydrochloric Acid SCHEMBL6203124 0.78 CA1 (0.46) CA1CA2MEN1KMT2AAPOB
SCHEMBL6502466 0.71 MEN1 (0.55) MEN1KMT2AAPOBMTTPMTNR1A
SCHEMBL7906062 0.68 APOB (0.48) CA1CA2ACHEAPOBMTTP
SCHEMBL7957926 0.68 CA1 (0.45) CA1CA2MEN1KMT2AAPOB
SCHEMBL6196616 0.67 APOB (0.45) CA1CA2MEN1KMT2AAPOB
SCHEMBL8765995 0.67 MTNR1A (0.62) CA1CA2ACHEMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors DAISO CO., LTD. (JP) 2005-02-17 — — US disclosed
EP-1472226-A1 HETEROCYCLIC AMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-11-03 — — EP disclosed
WO-2003045921-A1 HETEROCYCLIC AMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-06-05 — — WO 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-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors APOB, APOL1, CTRB2 CA1 2761/4885CA2 1990/4885ACHE 1056/4885

“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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