SCHEMBL4448522

SCHEMBL4448522

CNC(=O)C(NC(=O)c1ccc(C(C)(C)C)cc1)C(c1ccccc1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.54
NR1H4 Q96RI1 2/20 0.50
KCNK9 Q9NPC2 1/20 0.48
RAB9A P51151 4/20 0.46
LMNA P02545 2/20 0.46
ALDH1A1 P00352 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
PKM P14618 1/20 0.45
MTTP P55157 1/20 0.45
HDAC1 Q13547 1/20 0.44
NPC1 O15118 2/20 0.44
ADAM17 P78536 1/20 0.43
HPGDS O60760 1/20 0.42

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
SCHEMBL4448518 1.00 L3MBTL1 (0.54) L3MBTL1NR1H4KCNK9RAB9ALMNA
SCHEMBL4452601 0.90 L3MBTL1 (0.44) L3MBTL1NR1H4KCNK9RAB9ALMNA
SCHEMBL4452596 0.90 L3MBTL1 (0.44) L3MBTL1NR1H4KCNK9RAB9ALMNA
SCHEMBL13960116 0.87 CTSL (0.48) L3MBTL1NR1H4KCNK9RAB9ALMNA
SCHEMBL4456080 0.86 DGAT1 (0.43) L3MBTL1LMNAALDH1A1HDAC1NPC1
SCHEMBL4456084 0.86 DGAT1 (0.43) L3MBTL1LMNAALDH1A1HDAC1NPC1
SCHEMBL4445027 0.86 HPGDS (0.59) L3MBTL1RAB9ALMNAALDH1A1SMN1; SMN2
SCHEMBL4445032 0.86 HPGDS (0.59) L3MBTL1RAB9ALMNAALDH1A1SMN1; SMN2
SCHEMBL4456912 0.85 KDM4E (0.55) LMNAALDH1A1NPC1
SCHEMBL4456906 0.85 KMT2A (0.49) L3MBTL1LMNAALDH1A1KMT2ASMN1; SMN2

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-20090012010-A1 Amino acid derivatives as calcium channel blockers NEUROMED PHRAMACEUTICALS LTD. (CA) 2009-01-08 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-20090012010-A1 Amino acid derivatives as calcium channel blockers CACNA1G, CACNA1H, CACNA1I L3MBTL1 1802/4885NR1H4 2049/4885KCNK9 226/4885

“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.