SCHEMBL22548795

SCHEMBL22548795

CN(Cc1cccc(C(=O)C(C)(C)C)c1)C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ RIPK1 Q13546 3/20 0.40
▸ HSD17B1 P14061 2/20 0.40
▸ HSD17B2 P37059 2/20 0.40
▸ MEP1B Q16820 3/20 0.38
▸ MEP1A Q16819 1/20 0.38
▸ PTPN1 P18031 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ ACHE P22303 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ FOLH1 Q04609 1/20 0.37

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
SCHEMBL12632265 0.87 KMT2A (0.45) KMT2AMEN1L3MBTL1RIPK1HSD17B1
SCHEMBL25488466 0.84 MEP1B (0.54) KMT2AMEN1L3MBTL1MEP1BFOLH1
SCHEMBL27261961 0.80 CES2 (0.42) KMT2AMEN1MEP1BMEP1APTPN1
SCHEMBL855148 0.78 KAT6A (0.48) L3MBTL1ACHEFOLH1
SCHEMBL6293976 0.78 PRSS1 (0.50) HSD17B1HSD17B2MAPTRAB9ASMN1; SMN2
SCHEMBL14850048 0.77 ACHE (0.41) ACHEFOLH1
SCHEMBL17192801 0.77 ACHE (0.45) ACHEFOLH1
SCHEMBL19704118 0.77 CYP2D6 (0.42) ACHEFOLH1
SCHEMBL13028737 0.77 LOXL2 (0.60) ALDH1A1SMN1; SMN2ACHEFOLH1
SCHEMBL10031819 0.75 ACHE (0.52) L3MBTL1ACHE

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-20200323814-A1 MEDICAL COMPOUND VERA SALUS RICERCA S.R.L. (IT) 2020-10-15 — — 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-20200323814-A1 MEDICAL COMPOUND MTNR1B, CBR1, MTNR1A KMT2A 3998/4885MEN1 591/4885L3MBTL1 2406/4885

“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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